EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

rose acetate
rose crystals

Sponsors

Fragrance Demo Formulas
Name:(2,2,2-trichloro-1-phenylethyl) acetate
CAS Number: 90-17-5Picture of molecule3D/inchi
Other:39347-18-7
ECHA EINECS - REACH Pre-Reg:201-972-0
FDA UNII:4VE62Y0O29
Nikkaji Web:J50.598F
Beilstein Number:2270144
MDL:MFCD00000804
XlogP3-AA:3.50 (est)
Molecular Weight:267.53613000
Formula:C10 H9 Cl3 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:white crystalline powder (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 188.00 to 191.00 °C. @ 760.00 mm Hg
Boiling Point: 350.98 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.000042 mm/Hg @ 25.00 °C. (est)
Flash Point:> 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 3.527 (est)
Soluble in:
 alcohol
 water, 9.645 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
Substantivity:400 hour(s) at 20.00 % in dipropylene glycol
rose floral powdery
Odor Description:at 10.00 % in dipropylene glycol. heavy deep rose floral powdery
Luebke, William tgsc, (1982)
Odor sample from: Berje Inc.
Odor and/or flavor descriptions from others (if found).
PerfumersWorld
Rosone Rose Crystals
Odor Description:heavy floral powdery rose
Blends-well-with - +Aldehyde C11 undecylenic
Pell Wall Perfumes
Rose Crystals
Odor Description:Mild, floral-rose, balsamic
Arctander says that this material “has found wide application in perfume compositions as a fixative in Rose and Geranium compounds, soap fragrances, powder perfumes, etc. because of its excellent stability and fixative effect. Its odor is better understood upon evaluation of Phenylethylalcohol with and without 5% of this material. There are still perfumers who find the title ester odorless or without any perfumery value, and it is sometimes because the material has been judged too hastily without a compounding experiment.
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Anhui Haibei
Rosalin
Odor: Heavy deep rose floral
Augustus Oils
Rose Acetol
Services
Berjé
Rose Crystals
Happening at Berje
BOC Sciences
For experimental / research use only.
-(Trichloromethyl)benzyl acetate
CG Herbals
Rose Crystal
Creatingperfume.com
Rose Crystals
Odor: Heavy, deep rose, floral powdery
ECSA Chemicals
Rosacetol
Company Profile
Ernesto Ventós
ROSALIN
Fleurchem
rose crystals
Fuzhou Farwell
Rosalin
Indukern F&F
ROSECRYSTAL
Odor: FLORAL, ROSE, POWDERY
Inoue Perfumery
ROSEPHENONE
Jiangyin Healthway
Rosonc
New functional food ingredients
Keva
ROSE CRYSTALS
Kunshan Sainty
Rosalin, Kosher
Lluch Essence
ROSE CRYST.
M&U International
ROSALIN
Moellhausen
ROSALIN
OQEMA
Rosalin
PCW France
Rosacetol
Steps to a fragranced product
Pearlchem Corporation
Rose Crystal
Pell Wall Perfumes
Rose Crystals
Odor: Mild, floral-rose, balsamic
Use: Arctander says that this material “has found wide application in perfume compositions as a fixative in Rose and Geranium compounds, soap fragrances, powder perfumes, etc. because of its excellent stability and fixative effect. Its odor is better understood upon evaluation of Phenylethylalcohol with and without 5% of this material. There are still perfumers who find the title ester odorless or without any perfumery value, and it is sometimes because the material has been judged too hastily without a compounding experiment.
Penta International
TRICHLOROMETHYL PHENYL CARBINYL ACETATE
PerfumersWorld
Rosone Rose Crystals 10% in DPG
PerfumersWorld
Rosone Rose Crystals
Odor: heavy floral powdery rose
Use: Blends-well-with - +Aldehyde C11 undecylenic
Prodasynth
ROSE ACETATE > 99
Odor: ROSE
Reincke & Fichtner
Trichloromethyl Phenyl Carbinyl Acetate
Silverline Chemicals
Rose Crystals
SRS Aromatics
ROSALIN
Sunaux International
Rosalin
Tadimety Aromatics
Rose Crystals Ex Benzaldehyde
Odor: Floral, Sweet powdery Balsamic
Taytonn
Rosalin
The John D. Walsh Company
Rose Crystals
The Lermond Company
Rose Crystals
The Perfumers Apprentice
Rose Crystals
Odor: powdery rose
Treatt
Trichloromethyl Phenyl Carbinyl Acetate
Zanos
Rose Crystals ex Benzaldehyde
Odor: Floral, sweet powdery balsamic.
 
Safety Information:
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Human Experience:
1 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50 6800 mg/kg
Food and Cosmetics Toxicology. Vol. 13, Pg. 919, 1975.

Dermal Toxicity:
skin-rabbit LD50 > 2000 mg/kg
Food and Cosmetics Toxicology. Vol. 13, Pg. 919, 1975.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
Recommendation for rose acetate usage levels up to:
  0.8000 % in the fragrance concentrate.
 
Recommendation for rose acetate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):90-17-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :7007
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
(2,2,2-trichloro-1-phenylethyl) acetate
Chemidplus:0000090175
RTECS:AJ8375000 for cas# 90-17-5
 
References:
 (2,2,2-trichloro-1-phenylethyl) acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:90-17-5
Pubchem (cid):7007
Pubchem (sid):134970787
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2915.40.0000
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
decanal (aldehyde C-10)
FL/FR
6,7,8-
decen-1-ol
FR
9-
decenal
FL/FR
nonanal (aldehyde C-9)
FL/FR
nonanal diethyl acetal
FL/FR
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
amber
ambroxan
FL/FR
animal
iso
butyl quinoline
FR
costus valerolactone
FR
anisic
para-
anisaldehyde
FL/FR
balsamic
amyris wood oil
FL/FR
siam
benzoin resinoid
FL/FR
benzyl benzoate
FL/FR
benzyl salicylate
FL/FR
iso
butyl cinnamate
FL/FR
cinnamyl alcohol
FL/FR
clover nitrile
FR
ethyl cinnamate
FL/FR
methyl (E)-cinnamate
FL/FR
berry
raspberry ketone
FL/FR
chocolate
iso
amyl phenyl acetate
FL/FR
cocoa pentenal
FL/FR
citrus
abronia fragrance
FR
bergamot oil bergaptene reduced italy
FL/FR
citronitrile (Symrise)
FR
grapefruit pentanol
FR
10-
undecen-1-ol
FL/FR
floral
alpha-
amyl cinnamaldehyde
FL/FR
iso
amyl salicylate
FL/FR
iso
amyl undecylenate
FL/FR
benzyl acetate
FL/FR
benzyl alcohol
FL/FR
bois de rose oil brazil
FL/FR
laevo-
citronellol
FL/FR
citronellol
FL/FR
citronellyl anthranilate
FL/FR
coriander seed oil
FL/FR
cyclamen aldehyde
FL/FR
cyclohexyl ethyl alcohol
FL/FR
(Z)-alpha-
damascone
FL/FR
gamma-
damascone
FR
9-
decen-1-ol
FL/FR
dihydrojasmone
FL/FR
dimethyl anthranilate
FL/FR
dimethyl benzyl carbinol
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
ethyl phenoxyacetate
FR
ethyl phenyl acetate
FL/FR
farnesyl acetate
FL/FR
floral pyran
FR
floral pyranol
FR
geraniol
FL/FR
geranium oil egypt
FL/FR
geranium oil egypt fractions
FR
geranium oil terpeneless
FL/FR
geranium petiole oil india
FL/FR
geranium rose oil
FL/FR
geranium rose-scented oil cuba
FR
geranyl acetate
FL/FR
(E)-
geranyl linalool
FL/FR
glycoacetal
FR
hawthorn ethanol
FR
heliotropin
FL/FR
heliotropyl diethyl acetal
FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
ho leaf oil
FR
hyacinth ether
FR
hydroxycitronellal
FL/FR
leerall
FR
linalool
FL/FR
laevo-
linalool
FL/FR
linalool oxide
FL/FR
methyl dihydrojasmonate
FL/FR
2-
methyl octanal
FL/FR
muguet carboxaldehyde
FR
muguet octadienol
FR
musk acetate
FR
nerol
FL/FR
nerolidol
FL/FR
neryl acetate
FL/FR
neryl isovalerate
FL/FR
nonanol
FL/FR
ocean propanal
FL/FR
octyl isovalerate
FL/FR
peony alcohol
FR
phenethyl acetate
FL/FR
phenethyl alcohol
FL/FR
phenethyl anthranilate
FL/FR
phenethyl heptanoate
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl lactate
FL/FR
phenethyl phenyl acetate
FL/FR
phenethyl propionate
FL/FR
phenethyl salicylate
FL/FR
phenyl acetaldehyde digeranyl acetal
FR
primrose fragrance
FR
iso
propyl phenyl acetate
FL/FR
rhodinol
FL/FR
rhodinol substitues
FL/FR
rhodinyl acetate substitutes
FL/FR
rosa alba flower oil CO2 extract
FR
rose absolute (rosa centifolia)
FL/FR
rose absolute (rosa centifolia) morocco
FL/FR
rose absolute (rosa damascena) bulgaria
FL/FR
rose absolute (rosa damascena) turkey
FL/FR
rose absolute pentanol
FR
rose blossom pentanol
FR
rose butanoate
FL/FR
rose concrete (rosa centifolia)
FR
rose concrete (rosa damascena)
FR
rose oil (rosa centifolia) egypt
FL/FR
rose oil (rosa damascena) bulgaria
FL/FR
rose oil (rosa damascena) iran
FL/FR
rose oil (rosa damascena) turkey
FL/FR
rose oil replacer
FR
rose pyran
FR
tetrahydrolinalool
FL/FR
2-
undecen-1-ol
FL/FR
(E)-2-
undecen-1-ol
FL/FR
violet methyl carbonate
FR
fresh
decyl vinyl ether
FR
fruity
benzyl propionate
FL/FR
(E)-alpha-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
ethyl para-methyl-beta-phenyl glycidate
FR
green acetate
FR
plum crotonate
FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
green
acetaldehyde ethyl phenethyl acetal
FL/FR
cortex pyridine
FL/FR
iso
decanal
FL/FR
2-
heptyl tetrahydrofuran
FR
(Z)-3-
hexen-1-ol
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl benzoate
FL/FR
2,4-
ivy carbaldehyde
FL/FR
melon nonenoate
FL/FR
[(4E,4Z)-5-
methoxy-3-methyl-4-penten-1-yl] benzene
FR
phenyl acetaldehyde dimethyl acetal
FL/FR
3-
phenyl propionaldehyde
FL/FR
violet leaf absolute
FL/FR
herbal
chamomile valerate
FR
clary sage oil france
FL/FR
daucus carota fruit oil
FL/FR
linalyl acetate
FL/FR
laevo-
menthyl propionate
FL/FR
rose oil (rosa centifolia) morocco
FL/FR
honey
methyl phenyl acetate
FL/FR
marine
marine pyridine
FR
melon
watermelon ketone
FR
mossy
veramoss (IFF)
FR
naphthyl
beta-
naphthyl ethyl ether
FL/FR
powdery
para-
anisyl acetate
FL/FR
para-
anisyl alcohol
FL/FR
spicy
benzyl isoeugenol
FL/FR
cinnamyl acetate
FL/FR
iso
eugenyl acetate
FL/FR
maja fragrance
FR
methyl isoeugenol
FL/FR
pepper hexanone
FR
terpenic
alpha-
terpineol
FL/FR
tonka
coumarin
FR
tonka bean absolute
FR
vanilla
ethyl vanillin
FL/FR
vanilla bean absolute (vanilla planifolia)
FL/FR
vanillyl acetate
FL/FR
woody
amber carbinol
FR
patchouli ethanone
FR
santall
FR
woody acetate
FR
(Z)-
woody amylene
FR
For Flavor
No flavor group found for these
iso
amyl undecylenate
FL/FR
(Z)-alpha-
damascone
FL/FR
iso
decanal
FL/FR
9-
decenal
FL/FR
(E)-
geranyl linalool
FL/FR
laevo-
menthyl propionate
FL/FR
methyl (E)-cinnamate
FL/FR
2-
methyl octanal
FL/FR
nonanal diethyl acetal
FL/FR
octyl isovalerate
FL/FR
phenethyl heptanoate
FL/FR
phenethyl lactate
FL/FR
rhodinyl acetate substitutes
FL/FR
rose absolute (rosa damascena) bulgaria
FL/FR
rose absolute (rosa damascena) turkey
FL/FR
(E)-2-
undecen-1-ol
FL/FR
2-
undecen-1-ol
FL/FR
10-
undecen-1-ol
FL/FR
aldehydic
aldehydic
nonanal (aldehyde C-9)
FL/FR
balsamic
siam
benzoin resinoid
FL/FR
benzyl benzoate
FL/FR
benzyl salicylate
FL/FR
iso
butyl cinnamate
FL/FR
ethyl cinnamate
FL/FR
berry
raspberry ketone
FL/FR
rhodinol substitues
FL/FR
cherry
heliotropin
FL/FR
citrus
bergamot oil bergaptene reduced italy
FL/FR
linalool
FL/FR
laevo-
linalool
FL/FR
nerol
FL/FR
alpha-
terpineol
FL/FR
creamy
para-
anisaldehyde
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
fatty
(Z)-3-
hexen-1-yl benzoate
FL/FR
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
floral
iso
amyl phenyl acetate
FL/FR
bois de rose oil brazil
FL/FR
citronellol
FL/FR
laevo-
citronellol
FL/FR
cocoa pentenal
FL/FR
dihydrojasmone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
farnesyl acetate
FL/FR
geraniol
FL/FR
geranium oil egypt
FL/FR
geranium oil terpeneless
FL/FR
geranium petiole oil india
FL/FR
geranium rose oil
FL/FR
linalyl acetate
FL/FR
methyl dihydrojasmonate
FL/FR
methyl phenyl acetate
FL/FR
neryl acetate
FL/FR
ocean propanal
FL/FR
phenethyl alcohol
FL/FR
phenethyl anthranilate
FL/FR
phenethyl propionate
FL/FR
rhodinol
FL/FR
rose absolute (rosa centifolia)
FL/FR
rose absolute (rosa centifolia) morocco
FL/FR
rose oil (rosa centifolia) egypt
FL/FR
rose oil (rosa damascena) bulgaria
FL/FR
rose oil (rosa damascena) iran
FL/FR
rose oil (rosa damascena) turkey
FL/FR
tetrahydrolinalool
FL/FR
fruity
para-
anisyl acetate
FL/FR
para-
anisyl alcohol
FL/FR
benzyl acetate
FL/FR
benzyl alcohol
FL/FR
benzyl propionate
FL/FR
citronellyl anthranilate
FL/FR
(E)-alpha-
damascone
FL/FR
(E)-beta-
damascone
FL/FR
dimethyl anthranilate
FL/FR
neryl isovalerate
FL/FR
rose butanoate
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
green
acetaldehyde ethyl phenethyl acetal
FL/FR
iso
amyl salicylate
FL/FR
cinnamyl alcohol
FL/FR
cortex pyridine
FL/FR
cyclamen aldehyde
FL/FR
cyclohexyl ethyl alcohol
FL/FR
geranyl acetate
FL/FR
(Z)-3-
hexen-1-ol
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
2,4-
ivy carbaldehyde
FL/FR
linalool oxide
FL/FR
melon nonenoate
FL/FR
nerolidol
FL/FR
phenyl acetaldehyde dimethyl acetal
FL/FR
3-
phenyl propionaldehyde
FL/FR
violet leaf absolute
FL/FR
herbal
clary sage oil france
FL/FR
coriander seed oil
FL/FR
daucus carota fruit oil
FL/FR
rose oil (rosa centifolia) morocco
FL/FR
honey
ethyl phenyl acetate
FL/FR
phenethyl acetate
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl phenyl acetate
FL/FR
iso
propyl phenyl acetate
FL/FR
medicinal
dimethyl benzyl carbinol
FL/FR
phenethyl salicylate
FL/FR
powdery
beta-
naphthyl ethyl ether
FL/FR
spicy
benzyl isoeugenol
FL/FR
cinnamyl acetate
FL/FR
iso
eugenyl acetate
FL/FR
methyl isoeugenol
FL/FR
tropical
alpha-
amyl cinnamaldehyde
FL/FR
vanilla
ethyl vanillin
FL/FR
vanilla bean absolute (vanilla planifolia)
FL/FR
vanillyl acetate
FL/FR
waxy
decanal (aldehyde C-10)
FL/FR
9-
decen-1-ol
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
hydroxycitronellal
FL/FR
nonanol
FL/FR
woody
ambroxan
FL/FR
amyris wood oil
FL/FR
 
Potential Uses:
FRaldehydic
FRautumn
FRazalea
FRbouquet
FRcarnation
FRchamomile
FRcitrus
 clove blossom
FL/FRcurrant bud absolute replacer
 dahlia
FRdaisy
FRdaphne
FRdavana oil replacer
FRelder berry
FRfagonia
 fantasy blends
 fixer
FRfloral
 foliage
FRfruit
FRgeranium
FRgreen
FRguava
FRhyacinth
FRhydrangea
FRleather
FRlily of the valley
 metal by paco rabanne
 millefleurs
FRmoss
FRmusk
FRpeony
FRpeppermint
FRpetunia
FRphlox
 poppy
FRpowder
FRrain
FRreseda
FRrose
FRrose absolute replacer
FRrose d'orient
FRrose dog rose
FRrose geranium
FRrose moss rose
FRrose red rose
FRrose tea rose
FRrose white rose
FRrosemary
FRscented stock
FRstephanotis
FRtobacco
FRtulip
FRwisteria
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 acetic acid alpha-(trichloromethyl) benzyl ester
 acetic acid, a-(trichloromethyl)benzyl ester
 benzenemethanol, a-(trichloromethyl)-, acetate
 benzyl alcohol, a-(trichloromethyl)-, acetate
 plifenat
 rosacetol
 rosalin
 rose acetate
 rose crystals
 rosephenone
 rosone
 trichlor methyl phenyl carbinyl acetate
 trichlor phenyl methyl carbinyl acetate
2,2,2-trichloro-1-phenyl ethyl acetate
2,2,2-trichloro-1-phenylethyl acetate
(2,2,2-trichloro-1-phenylethyl) acetate
 trichloromethyl phenyl carbinyl acetate
alpha-(trichloromethyl) benzene methanol acetate
a-(trichloromethyl) benzenemethanol acetate
alpha-(trichloromethyl) benzyl acetate
alpha-(trichloromethyl) benzyl alcohol acetate
a-(trichloromethyl)benzenemethanol acetate
a-(trichloromethyl)benzyl acetate
 trichloromethylphenylcarbinyl acetate
 

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