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

dimethyl benzyl carbinyl propionate
benzeneethanol, a,a-dimethyl-, propanoate

Sponsors

CAS Number: 67785-77-7Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:267-072-5
Nikkaji Web:J260.933I
XlogP3-AA:3.20 (est)
Molecular Weight:206.28486000
Formula:C13 H18 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
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 96.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.98000 to 0.98800 @ 25.00 °C.
Pounds per Gallon - (est).: 8.155 to 8.221
Specific Gravity:0.98100 to 0.98900 @ 20.00 °C.
Pounds per Gallon - est.: 8.172 to 8.239
Refractive Index:1.48700 to 1.49200 @ 20.00 °C.
Boiling Point: 275.00 to 276.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.005000 mm/Hg @ 25.00 °C. (est)
Flash Point:> 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 3.572 (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, 17.74 mg/L @ 25 °C (est)
Insoluble in:
 water
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butyl propionate
isobutyl propionate
tert-butyl propionate
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(E)-2-hexen-1-yl propionate
(Z)-3-hexen-1-yl propionate
hexyl propionate
linalyl propionate
maltyl propionate
menthyl propionate
laevo-menthyl propionate
2-methyl butyl propionate
methyl propionate
nerolidyl propionate
neryl propionate
nonisyl propionate
nonyl propionate
(Z)-3-octen-1-yl propionate
(Z)-5-octen-1-yl propionate
octyl propionate
phenethyl propionate
phenoxyethyl propionate
3-phenyl propyl propionate
propyl propionate
isopropyl propionate
rhodinyl propionate
sorbyl propionate
styralyl propionate
sulfuryl propionate
terpinyl propionate
tetrahydrofurfuryl propionate
tricyclodecenyl propionate
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
Substantivity:100 hour(s) at 100.00 %
sweet jasmin hairy tea natural
Odor Description:at 100.00 %. sweet jasmin hairy tea natural
Luebke, William tgsc, (1993)
Odor sample from: International Flavors & Fragrances Inc.
Flavor Type: fruity
">fruity berry seedy green privet floral tropical plum raisin
Taste Description: fruity berry seedy green privet floral tropical plum raisin
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
Apple Flavor & Fragrance
DMBCP,Dimethyl benzyl carbinyl propionate
Berjé
Dimethyl Benzyl Carbinyl Proprionate
Happening at Berje
Fleurchem
benzyl dimethyl carbinyl propionate
Nagar Haveli Perfumes & Aromatics
Dimethyl Benzyl Carbinyl Propionate
Odor: weet jasmin hairy tea natural
Pearlchem Corporation
Dimethyl Benzyl Carbinyl Propionate
Penta International
DIMETHYL BENZYL CARBINYL PROPIONATE
Vigon International
Dimethyl Benzyl Carbinyl Propionate
Odor: SWEET, FLORAL, FRUITY
 
Safety Information:
 
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 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 18, Pg. 669, 1980.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 18, Pg. 669, 1980.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: fragrance agents
Recommendation for dimethyl benzyl carbinyl propionate usage levels up to:
  3.0000 % in the fragrance concentrate.
 
Recommendation for dimethyl benzyl carbinyl propionate flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):67785-77-7
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :105595
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
(2-methyl-1-phenylpropan-2-yl) propanoate
Chemidplus:0067785777
 
References:
 (2-methyl-1-phenylpropan-2-yl) propanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:67785-77-7
Pubchem (cid):105595
Pubchem (sid):135063219
 
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
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2915.50.3000
ChemSpider:View
 
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For Odor
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FR
aromatic
(4E,9Z)-13-
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para-
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2-
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pentenyl cyclopentanone
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2-
pentyl cyclopentan-1-ol
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tea acetate
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wallflower absolute
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ylang ylang oil III fractions
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fruity
peach nitrile
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herbal
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FR
petitgrain heptane
FR
woody
cyperus root oil (cyperus rotundus)
FR
(-)-
guaiol
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For Flavor
No flavor group found for these
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costus root resinoid
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elecampane root oil
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coffee
coffee
2,4-
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FL
methyl thiomethyl butyrate
FL
 
Potential Uses:
 hair
FRjasmin
 natural
 tea
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 benzeneethanol, a,a-dimethyl-, propanoate
 benzyl dimethyl carbinyl propionate
 benzyl isopropyl propionate
 benzyl propyl propionate
 benzylisopropyl propionate
 dimethyl benzyl carbinol propionate
 dimethyl benzyl carbinyl proprionate
alpha,-alpha-dimethyl phenethyl propionate
alpha,alpha-dimethyl phenyl ethyl propionate
 dimethylbenzylcarbinyl propionate
 hairy propionate
2-methyl-1-phenylpropan-2-yl propionate
(2-methyl-1-phenylpropan-2-yl) propanoate
 phenethyl alcohol, a,a-dimethyl-, propionate
 propanoic acid (3-phenyl-2-methyl-2-propyl) ester
 propanoic acid 1,1-dimethyl-2-phenyl ethyl ester
 propanoic acid, (3-phenyl-2-methyl-2-propyl) ester
 propanoic acid, 1,1-dimethyl-2-phenylethyl ester
 

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