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labdanum ethanone
orinox (PFW)

Sponsors

Name:1-(4-tert-butyl-2,6-dimethylphenyl)ethanone
CAS Number: 2040-10-0Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:218-037-8
FDA UNII:UN0DL0NR1U
Nikkaji Web:J60.318J
MDL:MFCD00026301
XlogP3-AA:4.00 (est)
Molecular Weight:204.31260000
Formula:C14 H20 O
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 to pale yellow solid (est)
Assay: 99.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 46.00 to 47.00 °C. @ 760.00 mm Hg
Boiling Point: 280.00 to 281.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.002000 mm/Hg @ 25.00 °C. (est)
Flash Point:> 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 2.913 (est)
Shelf Life: 24.00 month(s) or longer if stored properly.
Storage:store in cool, dry place in tightly sealed containers, protected from heat and light.
Soluble in:
 alcohol
 water, 4.209 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 cream
 detergent
 fabric softener
 soap
 
Organoleptic Properties:
Odor Type: woody
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
Substantivity:504 hour(s) at 100.00 %
dry woody labdanum rose musk orangeflower
Odor Description:at 10.00 % in dipropylene glycol. strong dry woody labdanum rose musk orangeflower
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Creatingperfume.com
Orinox 50 (PFW)
Odor: strong dry woody Labdanum rose character, with a musky orange blossom background
Keva
ORINOX
Odor: has a strong dry woody Labdanum rose character, with a musky orange blossom background
Moellhausen
ORINOX
Odor: woody, floral (labdanum, rose), musky
PCW France
Orinox™
Steps to a fragranced product
Penta International
4-tert-BUTYL-2,6-DIMETHYLACETOPHENONE
Perfumery Laboratory
LABDANUM ETANON 50 PFW (labdanum ethanone 50 PFW)
Odor: very strong, dry, musky musk of labdanum with a note of orange blossoms
Sigma-Aldrich: Aldrich
For experimental / research use only.
4'-tert-Butyl-2',6'-dimethylacetophenone 98%
SRS Aromatics
ORINOX
The John D. Walsh Company
Orinox
 
Safety Information:
Preferred SDS: View
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.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
Recommendation for labdanum ethanone usage levels up to:
  1.0000 % in the fragrance concentrate.
 
Recommendation for labdanum ethanone flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):2040-10-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :74879
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
1-(4-tert-butyl-2,6-dimethylphenyl)ethanone
Chemidplus:0002040100
 
References:
 1-(4-tert-butyl-2,6-dimethylphenyl)ethanone
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):74879
Pubchem (sid):135031200
 
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
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
decanal (aldehyde C-10)
FL/FR
dodecanal (aldehyde C-12 lauric)
FL/FR
2-
methyl undecanal (aldehyde C-12 mna)
FL/FR
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
amber
amber acetate
FR
amber cyclohexanol
FR
amber specialty
FR
amber spirolene
FR
ambergris tincture
FL/FR
ambrein
FR
ambrette seed absolute
FL/FR
ambroxan
FL/FR
cistus ladaniferus resinoid
FR
animal
animal carbolactone
FR
costus valerolactone
FR
indole
FL/FR
balsamic
amyris wood oil
FL/FR
siam
benzoin resinoid
FL/FR
1-
benzoyl acetone
FL/FR
benzyl cinnamate
FL/FR
benzyl salicylate
FL/FR
iso
bornyl acetate
FL/FR
iso
butyl cinnamate
FL/FR
cinnamyl alcohol
FL/FR
ethyl cinnamate
FL/FR
fir needle oil siberia
FL/FR
mastic gum resin
FR
methyl (E)-cinnamate
FL/FR
myrrh oil
FL/FR
peru balsam oil
FL/FR
3-
phenyl propyl alcohol
FL/FR
bitter
gentian absolute
FL/FR
caramellic
ethyl maltol
FL/FR
maltol
FL/FR
citrus
bitter
orange peel oil
FL/FR
fatty
decanol
FL/FR
floral
acetyl tetralin
FR
alpha-
amyl cinnamaldehyde
FL/FR
iso
amyl salicylate
FL/FR
benzyl alcohol
FL/FR
bois de rose oil brazil
FL/FR
coriander seed oil
FL/FR
cyclamen aldehyde
FL/FR
cyclohexyl ethyl alcohol
FL/FR
dimethyl benzyl carbinol
FL/FR
floral pyranol
FR
floral undecenone
FR
gardenia oxide
FR
geranium oil bourbon
FL/FR
heliotropin
FL/FR
heliotropyl acetone
FL/FR
heliotropyl diethyl acetal
FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
ho leaf oil
FR
jasmin absolute egypt (from concrete)
FL/FR
iso
jasmone
FL/FR
linalool
FL/FR
linalool oxide
FL/FR
methyl dihydrojasmonate
FL/FR
mimosa absolute france
FL/FR
musk acetate
FR
ocean propanal
FL/FR
orris pyridine 25% IPM
FR
peony alcohol
FR
phenethyl alcohol
FL/FR
phenethyl salicylate
FL/FR
3-
phenyl propionic acid
FL/FR
primrose fragrance
FR
rhodinol
FL/FR
rose absolute (rosa damascena) bulgaria
FL/FR
tetrahydrolinalool
FL/FR
violet methyl carbonate
FR
ylang ylang flower oil
FL/FR
fresh
10-
undecen-1-yl acetate
FL/FR
fruity
allyl amyl glycolate
FR
allyl cyclohexyl propionate
FL/FR
allyl isononylate
FR
(E)-beta-
damascone
FL/FR
1-(3,3-
dimethyl bicyclo(2.2.1)hept-2-yl)-2-methyl cyclohex-3-ene carbaldehyde
FR
green acetate
FR
valeriana officinalis root extract
FL/FR
green
galbanum oil
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
hexyl tiglate
FL/FR
2,4-
ivy carbaldehyde
FL/FR
methyl cyclocitrone (IFF)
FR
oakmoss oil
FR
3-
phenyl propionaldehyde
FL/FR
seaweed absolute (fucus vesiculosus et serratus)
FL/FR
herbal
anthemis nobilis flower oil roman
FL/FR
clary sage oil france
FL/FR
clary specialty
FR
daucus carota fruit oil
FL/FR
herbal carene
FR
lavandin water absolute
FL/FR
lavender absolute bulgaria
FL/FR
nopyl acetate
FR
laevo-beta-
pinene
FL/FR
beta-
pinene
FL/FR
marine
marine pyridine
FR
melon
watermelon ketone
FR
mossy
oakmoss absolute
FL/FR
treemoss absolute
FR
veramoss (IFF)
FR
musk
dehydro beta-linalool
FL/FR
powdery
para-
anisyl acetate
FL/FR
para-
anisyl alcohol
FL/FR
midnight passion fragrance
FR
spicy
benzyl isoeugenol
FL/FR
beta-
caryophyllene
FL/FR
cassia bark oil china
FL/FR
clove bud oil
FL/FR
eugenol
FL/FR
iso
eugenyl acetate
FL/FR
alpha-
methyl cinnamaldehyde
FL/FR
methyl isoeugenol
FL/FR
black
pepper oil
FL/FR
terpenic
frankincense oil
FL/FR
juniperus communis fruit oil
FL/FR
alpha-
terpineol
FL/FR
tonka
coumarin
FR
deertongue absolute
FR
tonka bean absolute
FR
vanilla
ethyl vanillin
FL/FR
vanilla bean absolute (vanilla planifolia)
FL/FR
vanillyl acetate
FL/FR
waxy
1-
dodecanol
FL/FR
ethyl laurate
FL/FR
1-
undecanol
FL/FR
woody
beta-
caryophyllene alcohol acetate
FL/FR
atlas
cedarwood absolute
FR
atlas
cedarwood oil
FR
cedarwood oil alcohols
FL/FR
cedrela wood oil
FR
cedrenyl acetate
FR
cedrol methyl ether
FR
cedryl methyl ether
FR
2-
decalinyl formate
FR
frankincense resinoid
FL/FR
guaiacwood oil
FL/FR
guaiene
FL/FR
gurjun balsam oil
FR
hinoki root oil
FR
labdanum concrete
FR
louro brasileiro wood oil
FR
para-
menth-3-en-1-ol
FL/FR
2-
methoxy-4-vinyl phenol
FL/FR
methyl cedryl ketone
FL/FR
methyl vetivate
FR
patchouli ethanone
FR
patchouli fractions
FR
patchouli oil
FL/FR
sandalwood oil
FL/FR
sandalwood oil west australia (santalum spicata)
FR
santall
FR
thujopsis dolabrata wood oil
FR
tobacarol (IFF)
FR
vetiver oil haiti
FL/FR
woody acetate
FR
(Z)-
woody amylene
FR
woody ether
FR
woody propanol
FR
For Flavor
No flavor group found for these
ambergris tincture
FL/FR
1-
benzoyl acetone
FL/FR
beta-
caryophyllene alcohol acetate
FL/FR
cedarwood oil alcohols
FL/FR
dehydro beta-linalool
FL/FR
gentian absolute
FL/FR
para-
menth-3-en-1-ol
FL/FR
methyl (E)-cinnamate
FL/FR
3-
phenyl propionic acid
FL/FR
laevo-beta-
pinene
FL/FR
rose absolute (rosa damascena) bulgaria
FL/FR
seaweed absolute (fucus vesiculosus et serratus)
FL/FR
aldehydic
aldehydic
1-
undecanol
FL/FR
animal
indole
FL/FR
balsamic
siam
benzoin resinoid
FL/FR
benzyl salicylate
FL/FR
iso
butyl cinnamate
FL/FR
ethyl cinnamate
FL/FR
fir needle oil siberia
FL/FR
myrrh oil
FL/FR
peru balsam oil
FL/FR
berry
heliotropyl acetone
FL/FR
caramellic
ethyl maltol
FL/FR
maltol
FL/FR
cherry
heliotropin
FL/FR
citrus
linalool
FL/FR
bitter
orange peel oil
FL/FR
alpha-
terpineol
FL/FR
fatty
10-
undecenal (aldehyde C-11 undecylenic)
FL/FR
floral
bois de rose oil brazil
FL/FR
geranium oil bourbon
FL/FR
jasmin absolute egypt (from concrete)
FL/FR
methyl dihydrojasmonate
FL/FR
ocean propanal
FL/FR
phenethyl alcohol
FL/FR
rhodinol
FL/FR
tetrahydrolinalool
FL/FR
ylang ylang flower oil
FL/FR
fruity
allyl cyclohexyl propionate
FL/FR
para-
anisyl acetate
FL/FR
para-
anisyl alcohol
FL/FR
benzyl alcohol
FL/FR
(E)-beta-
damascone
FL/FR
valeriana officinalis root extract
FL/FR
greasy
10-
undecen-1-yl acetate
FL/FR
green
iso
amyl salicylate
FL/FR
cinnamyl alcohol
FL/FR
cyclamen aldehyde
FL/FR
cyclohexyl ethyl alcohol
FL/FR
galbanum oil
FL/FR
(Z)-3-
hexen-1-yl salicylate
FL/FR
(Z)-3-
hexen-1-yl tiglate
FL/FR
hexyl tiglate
FL/FR
2,4-
ivy carbaldehyde
FL/FR
iso
jasmone
FL/FR
linalool oxide
FL/FR
oakmoss absolute
FL/FR
3-
phenyl propionaldehyde
FL/FR
herbal
anthemis nobilis flower oil roman
FL/FR
clary sage oil france
FL/FR
coriander seed oil
FL/FR
daucus carota fruit oil
FL/FR
lavandin water absolute
FL/FR
lavender absolute bulgaria
FL/FR
medicinal
dimethyl benzyl carbinol
FL/FR
phenethyl salicylate
FL/FR
pine
beta-
pinene
FL/FR
smoky
2-
methoxy-4-vinyl phenol
FL/FR
soapy
dodecanal (aldehyde C-12 lauric)
FL/FR
1-
dodecanol
FL/FR
spicy
benzyl cinnamate
FL/FR
benzyl isoeugenol
FL/FR
beta-
caryophyllene
FL/FR
cassia bark oil china
FL/FR
clove bud oil
FL/FR
eugenol
FL/FR
iso
eugenyl acetate
FL/FR
alpha-
methyl cinnamaldehyde
FL/FR
methyl isoeugenol
FL/FR
black
pepper oil
FL/FR
3-
phenyl propyl alcohol
FL/FR
terpenic
juniperus communis fruit oil
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
decanol
FL/FR
ethyl laurate
FL/FR
alpha-
hexyl cinnamaldehyde
FL/FR
2-
methyl undecanal (aldehyde C-12 mna)
FL/FR
mimosa absolute france
FL/FR
woody
ambrette seed absolute
FL/FR
ambroxan
FL/FR
amyris wood oil
FL/FR
iso
bornyl acetate
FL/FR
frankincense oil
FL/FR
frankincense resinoid
FL/FR
guaiacwood oil
FL/FR
guaiene
FL/FR
methyl cedryl ketone
FL/FR
patchouli oil
FL/FR
sandalwood oil
FL/FR
vetiver oil haiti
FL/FR
 
Potential Uses:
FRamber
FRanimal
FRbalsam
FRfloral
FRherbal
FRlabdanum
FRmusk
FRorange blossom
FRoriental
FRwoody
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 acetophenone, 4'-tert-butyl-2',6'-dimethyl-
 acetophenone, 4'-tert-butyl-2',6'-dimethyl- (8CI)
1-acetyl-4-(tert-butyl)-2,6-dimethylbenzene
tert-butyl dimethyl acetophenone
1-(4-tert-butyl-2,6-dimethylphenyl)ethanone
4'-tert-butyl-2',6'-dimethyl acetophenone
4'-tert-butyl-2',6'-dimethylacetophenone
1-(4-(1,1-dimethyl ethyl)-2,6-dimethyl phenyl) ethanone
1-(4-(1,1-dimethylethyl)-2,6-dimethylphenyl) ethanone
 ethanone, 1-(4-(1,1-dimethylethyl)-2,6-dimethylphenyl)-
 ethanone, 1-[4-(1,1-dimethylethyl)-2,6-dimethylphenyl]-
 labdanum ethanone
 orinox (PFW)
 

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