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

tetrahydrolinalyl acetate
3-octanol, 3,7-dimethyl-, acetate

Sponsors

Fragrance Demo Formulas
Name:3,7-dimethyloctan-3-yl acetate
CAS Number: 20780-48-7Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:244-033-0
FDA UNII:2NDV3959AX
Nikkaji Web:J225.332A
XlogP3-AA:3.80 (est)
Molecular Weight:200.32168000
Formula:C12 H24 O2
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
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.85600 to 0.86600 @ 25.00 °C.
Pounds per Gallon - (est).: 7.123 to 7.206
Refractive Index:1.41600 to 1.42600 @ 20.00 °C.
Boiling Point: 211.75 °C. @ 760.00 mm Hg (est)
Vapor Pressure:0.180000 mm/Hg @ 25.00 °C. (est)
Flash Point: 167.00 °F. TCC ( 75.00 °C. )
logP (o/w): 4.451 (est)
Soluble in:
 alcohol
 water, 5.056 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
Substantivity:12 hour(s) at 100.00 %
fresh woody bergamot citrus floral
Odor Description:at 100.00 %. fresh woody bergamot citrus floral
Luebke, William tgsc, (1985)
Odor sample from: Givaudan Corporation
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Berjé
Tetra Hydro Linalyl Acetate
Happening at Berje
Lluch Essence
TETRAHYDROLINALYL ACETATE
Moellhausen
TETRAHYDROLINALYL ACETATE
Penta International
TETRAHYDROLINALYL ACETATE, Kosher
Reincke & Fichtner
Tetrahydrolinalyl Acetate
The John D. Walsh Company
Tetrahydro Linalyl Acetate
Treatt
Tetrahydrolinalyl Acetate
Vigon International
Tetrahydrolinalyl Acetate
Odor: FRESH, FLORAL, FRUITY, DRY, SLIGHTLY HERBACEOUS
Zanos
Tetrahydrolinalol Acetate
 
Safety Information:
European information :
Most important hazard(s):
Xi N - Irritant, Dangerous for the environment.
R 38 - Irritating to skin.
R 51/53 - Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
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 37/39 - Wear suitable gloves and eye/face protection.
 
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.
Oral/Parenteral Toxicity:
oral-rat LD50 4000 mg/kg
Givaudan Corporation

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
Recommendation for tetrahydrolinalyl acetate usage levels up to:
  10.0000 % in the fragrance concentrate.
 
Recommendation for tetrahydrolinalyl acetate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):20780-48-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :89385
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 3082
WGK Germany:2
3,7-dimethyloctan-3-yl acetate
Chemidplus:0020780487
 
References:
 3,7-dimethyloctan-3-yl acetate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:20780-48-7
Pubchem (cid):89385
Pubchem (sid):135046942
 
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:2915.39.9050
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
(Z)-2-
penten-1-yl hexanoate
FL/FR
aldehydic
aldehydic
decanal (aldehyde C-10)
FL/FR
mandarine undecenal
FL/FR
TMH aldehyde
FR
balsamic
balsam ketone
FR
benzyl benzoate
FL/FR
benzyl salicylate
FL/FR
brachyleana hutchinsii wood oil
FR
cyclohexyl benzoate
FL/FR
burnt
lepidine
FL/FR
citronella
4,8-
dimethyl-7-nonen-2-ol
FR
citrus
acetaldehyde citronellyl methyl acetal
FR
bergamot acetoacetate
FR
bergamot oil
FL/FR
bergamot oil bergaptene reduced italy
FL/FR
bergamot oil turkey
FL/FR
beta-
bisabolol
FL/FR
citral diethyl acetal
FL/FR
citronellal oxime
FR
citrus floral green fragrance
FR
citrus ocimenol
FR
citrus specialty
FR
dihydromyrcenol
FL/FR
dihydromyrcenyl acetate
FR
2,4-
dimethyl-3-cyclohexene-1-methanyl acetate
FR
2-
dodecanone
FL/FR
2-
ethyl-1-hexanol
FL/FR
citrus
floral fragrance
FR
2-
heptanol
FL/FR
lime octadienal
FR
lime oil distilled mexico
FL/FR
mandarin oil
FL/FR
mandarin oil (citrus reticulata nova var. mandarin) uruguay
FL/FR
mandarin oil italy
FL/FR
3-
methyl-4-(2-methyl butyl oxy) butyraldehyde
FR
alpha-
methylene citronellal
FR
myrcenyl acetate
FL/FR
nonanal dimethyl acetal
FL/FR
alpha-
terpinyl methyl ether
FL/FR
(±)-2,4,8-
trimethyl-7-nonen-2-ol
FL/FR
10-
undecen-1-ol
FL/FR
verbena fragrance
FR
floral
ortho-
acetyl-para-cresol
FL/FR
iso
amyl salicylate
FL/FR
amyl salicylate
FL/FR
benzyl pivalate
FL/FR
bois de rose oil brazil
FL/FR
butyl tiglate
FR
cassie absolute replacer
FL/FR
cassis cyclohexene
FR
citronellal
FL/FR
citronellyl formate
FL/FR
coriander seed oil
FL/FR
cymbopogon validus leaf oil
FR
dihydromyrcene
FR
2,4-
dimethyl-3-cyclohexene-1-methanol
FR
eau de brouts absolute
FR
ethyl linalool
FR
ethyl linalyl acetal
FR
gardenia acetal
FR
heather fragrance
FR
heliotrope absolute
FR
herbal pyran
FR
ho leaf oil
FR
ho wood oil
FR
ilex paraguariensis oleoresin
FL/FR
beta-
ionol
FL/FR
(Z)-
jasmone
FL/FR
iso
jasmone
FL/FR
karo karounde absolute
FR
lavandin concrete decolorized
FR
lavandin oil
FL/FR
lavandula angustifolia flower oil
FL/FR
lavender absolute replacer
FR
lavender oil
FL/FR
lavender oil bulgaria
FL/FR
lavender oil france
FL/FR
lavender oil greece
FL/FR
lavender oil replacer
FR
laevo-
linalool
FL/FR
linalool
FL/FR
linalyl anthranilate
FL/FR
linalyl benzoate
FL/FR
linalyl butyrate
FL/FR
linalyl propionate
FL/FR
muguet nitrile
FR
myrcenol
FL/FR
nerol
FL/FR
neroli oil tunisia
FL/FR
nerolidyl acetate
FL/FR
neryl isovalerate
FL/FR
nonisyl propionate
FR
(Z)-beta-
ocimene
FL/FR
palmarosa oil
FL/FR
pelargonium graveolens flower water
FR
peony acetonitrile
FR
petitgrain concrete
FR
petitgrain lemon oil
FL/FR
petitgrain oil morocco
FL/FR
iso
phytol
FL/FR
prenyl salicylate
FL/FR
sambucus nigra flower oil CO2 extract
FR
terpinyl formate
FL/FR
terpinyl isobutyrate
FL/FR
undecanal dimethyl acetal
FR
fruity
fruity cyclopentanone
FR
linalyl isobutyrate
FL/FR
nerolidyl isobutyrate
FR
ocimen-1-yl acetate
FR
sambucus canadensis fruit absolute
FL/FR
green
acetaldehyde di-(Z)-3-hexen-1-yl acetal
FL/FR
acetaldehyde ethyl phenethyl acetal
FL/FR
iso
butyl benzyl carbinol
FL/FR
iso
green methanoindene
FR
heptyl formate
FL/FR
(Z)-3-
hexen-1-yl angelate
FR
(E)-2-
hexen-1-yl salicylate
FR
dextro-
linalyl acetate
FL/FR
laevo-
linalyl acetate
FL/FR
marigold pot absolute
FL/FR
herbal
amber dioxepine
FR
bergamot mint herb oil
FR
calendula officinalis flower oil CO2 extract
FR
cananga fruit oil
FR
carrot seed oil (daucus carota ssp. gummifer hook. fil.) spain
FR
chamomile isobutyrate
FR
chrysanthemum ketone
FR
coriander seed absolute
FL/FR
cuminyl acetate
FL/FR
iso
dihydrolavandulal
FL/FR
delta-
elemene
FL/FR
immortelle flower oil
FL/FR
inula root oil
FR
lavandin flower water
FR
abrialis
lavandin oil
FL/FR
iso
lavandyl acetate
FR
lavender absolute bulgaria
FL/FR
lavender concrete
FL/FR
lavender oil terpeneless
FL/FR
lavender stem oil lithuania
FR
linalyl acetate
FL/FR
linalyl formate
FL/FR
linalyl isovalerate
FL/FR
marigold pot flower oil
FL/FR
laevo-
menthyl propionate
FL/FR
methyl cyclogeranate (Firmenich)
FR
methyl hexyl ether
FL/FR
methyl ortho-anisate
FL/FR
myrtle oil
FL/FR
myrtle oil morocco
FL/FR
nonisyl acetate
FR
nopyl acetate
FR
ocimene oxirane
FR
3-
octanone
FL/FR
3-
octyl acetate
FL/FR
terpineol acetate
FL/FR
alpha-
terpinyl acetate
FL/FR
orris
beta-
methyl ionone
FL/FR
spicy
carnation absolute
FR
white
sassafras oil
FL/FR
spicy carbonate
FR
zanthoxylum piperitum fruit absolute CO2 extract
FL/FR
terpenic
(E,E)-2,6-allo
ocimene
FL/FR
alpha-
terpineol
FL/FR
waxy
decanal dimethyl acetal
FL/FR
1-
undecanol
FL/FR
woody
2-
decalinyl acetate
FR
dihydro-beta-ionol
FL/FR
alpha-
farnesene
FL/FR
alpha-
farnesene isomer
FL/FR
iso
longifolene epoxide
FR
patchouli ethanone
FR
(Z)-
woody amylene
FR
zdravetz absolute
FR
zdravetz oil
FL/FR
For Flavor
No flavor group found for these
acetaldehyde di-(Z)-3-hexen-1-yl acetal
FL/FR
ortho-
acetyl-para-cresol
FL/FR
benzyl pivalate
FL/FR
cassie absolute replacer
FL/FR
cuminyl acetate
FL/FR
cyclohexyl benzoate
FL/FR
decanal dimethyl acetal
FL/FR
8,9-
dehydrotheaspirone
FL
dihydro-beta-ionol
FL/FR
delta-
elemene
FL/FR
ilex paraguariensis oleoresin
FL/FR
laevo-
linalyl acetate
FL/FR
dextro-
linalyl acetate
FL/FR
linalyl formate
FL/FR
mandarine undecenal
FL/FR
marigold pot flower oil
FL/FR
laevo-
menthyl propionate
FL/FR
methyl ortho-anisate
FL/FR
myrcenol
FL/FR
myrtle oil morocco
FL/FR
nerolidyl acetate
FL/FR
(E,E)-2,6-allo
ocimene
FL/FR
(Z)-2-
penten-1-yl hexanoate
FL/FR
white
sassafras oil
FL/FR
terpineol acetate
FL/FR
terpinyl isobutyrate
FL/FR
10-
undecen-1-ol
FL/FR
zdravetz oil
FL/FR
aldehydic
aldehydic
1-
undecanol
FL/FR
amber
iso
butyl benzyl carbinol
FL/FR
aromatic
amyl salicylate
FL/FR
balsamic
benzyl benzoate
FL/FR
benzyl salicylate
FL/FR
citrus
bergamot oil
FL/FR
bergamot oil bergaptene reduced italy
FL/FR
bergamot oil turkey
FL/FR
beta-
bisabolol
FL/FR
citral diethyl acetal
FL/FR
lime oil distilled mexico
FL/FR
laevo-
linalool
FL/FR
linalool
FL/FR
mandarin oil
FL/FR
mandarin oil (citrus reticulata nova var. mandarin) uruguay
FL/FR
mandarin oil italy
FL/FR
myrcenyl acetate
FL/FR
nerol
FL/FR
neroli oil tunisia
FL/FR
petitgrain lemon oil
FL/FR
petitgrain oil morocco
FL/FR
alpha-
terpineol
FL/FR
(±)-2,4,8-
trimethyl-7-nonen-2-ol
FL/FR
ethereal
methyl hexyl ether
FL/FR
fatty
2-
dodecanone
FL/FR
2-
ethyl-1-hexanol
FL/FR
heptyl formate
FL/FR
floral
bois de rose oil brazil
FL/FR
citronellal
FL/FR
beta-
ionol
FL/FR
pseudo
ionone
FL
lepidine
FL/FR
linalyl acetate
FL/FR
linalyl anthranilate
FL/FR
linalyl benzoate
FL/FR
linalyl butyrate
FL/FR
linalyl isobutyrate
FL/FR
beta-
methyl ionone
FL/FR
palmarosa oil
FL/FR
fruity
citronellyl formate
FL/FR
2-
heptanol
FL/FR
linalyl isovalerate
FL/FR
neryl isovalerate
FL/FR
sambucus canadensis fruit absolute
FL/FR
terpinyl formate
FL/FR
green
acetaldehyde ethyl phenethyl acetal
FL/FR
iso
amyl salicylate
FL/FR
dihydromyrcenol
FL/FR
alpha-
farnesene
FL/FR
alpha-
farnesene isomer
FL/FR
(E,E)-2,4-
hexadienal
FL
iso
jasmone
FL/FR
marigold pot absolute
FL/FR
nonanal dimethyl acetal
FL/FR
(Z)-beta-
ocimene
FL/FR
3-
octyl acetate
FL/FR
herbal
coriander seed absolute
FL/FR
coriander seed oil
FL/FR
iso
dihydrolavandulal
FL/FR
immortelle flower oil
FL/FR
lavandin oil
FL/FR
abrialis
lavandin oil
FL/FR
lavandula angustifolia flower oil
FL/FR
lavender absolute bulgaria
FL/FR
lavender concrete
FL/FR
lavender oil
FL/FR
lavender oil bulgaria
FL/FR
lavender oil france
FL/FR
lavender oil greece
FL/FR
lavender oil terpeneless
FL/FR
linalyl propionate
FL/FR
prenyl salicylate
FL/FR
mushroom
3-
octanone
FL/FR
oily
iso
phytol
FL/FR
spicy
myrtle oil
FL/FR
zanthoxylum piperitum fruit absolute CO2 extract
FL/FR
waxy
decanal (aldehyde C-10)
FL/FR
woody
(Z)-
jasmone
FL/FR
alpha-
terpinyl acetate
FL/FR
alpha-
terpinyl methyl ether
FL/FR
 
Potential Uses:
FRbergamot
FRcitrus
FRherbal
FRlavender
FRoriental
FRrose
FRwoody
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
3,7-dimethyl octan-3-yl acetate
3,7-dimethyl-3-octanol acetate
3,7-dimethyloctan-3-yl acetate
3-octanol, 3,7-dimethyl-, acetate
 tetra hydro linalyl acetate
 tetrahydro linalyl acetate
 
 
Notes:
None found
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