ChemicalBook Product Catalog Flavors and fragrances Synthetic fragrances Carboxylic acids and esters Aliphatic dicarboxylic acid esters Benzyldimethylcarbinyl butyrate

Benzyldimethylcarbinyl butyrate

Benzyldimethylcarbinyl butyrate Basic information
Product Name:Benzyldimethylcarbinyl butyrate
Synonyms:1,1-Dimethyl-2-phenylethyl butyrate;2-Benzyl-2-propylbutyrate;a,a-dimethylphenethyl;a,a-dimethylphenethylbutyrate;alpha,alpha-Dimethylphenethyl alcohol, butyrate;Benzyl dimethylcarbinyl n-butyrate;Butyric acid 1,1-dimethyl-2-phenylethyl ester;Dimethyl benzyl carbinyl butyrate(D.M.B.C.B.)
CAS:10094-34-5
MF:C14H20O2
MW:220.31
EINECS:233-221-8
Product Categories:Flavors and Fragrances;Alphabetical Listings;C-D
Mol File:10094-34-5.mol
Benzyldimethylcarbinyl butyrate Structure
Benzyldimethylcarbinyl butyrate Chemical Properties
Boiling point 237-255 °C(lit.)
density 0.969 g/mL at 25 °C(lit.)
vapor pressure 0.164Pa at 20℃
refractive index n20/D 1.4839(lit.)
FEMA 2394 | ALPHA,ALPHA-DIMETHYLPHENETHYL BUTYRATE
Fp >230 °F
Specific Gravity0.96
color Colorless liquid
Odorplum aroma
Odor Typefloral
Water Solubility 16.11mg/L at 20℃
JECFA Number1656
InChIKeySHSGYHAHMQLYRB-UHFFFAOYSA-N
LogP4.7 at 25℃
CAS DataBase Reference10094-34-5(CAS DataBase Reference)
NIST Chemistry ReferenceButanoic acid, 1,1-dimethyl-2-phenylethyl ester(10094-34-5)
EPA Substance Registry SystemButanoic acid, 1,1-dimethyl-2-phenylethyl ester (10094-34-5)
Safety Information
Hazard Codes Xi,N
Risk Statements 38-43-51/53
Safety Statements 36/37-61
RIDADR UN3082 9/PG 3
WGK Germany 2
RTECS ET0130000
ToxicityLD50 orl-rat: >5 g/kg FCTXAV 18,667,80
MSDS Information
ProviderLanguage
SigmaAldrich English
Benzyldimethylcarbinyl butyrate Usage And Synthesis
Chemical Propertiesα,α-Dimethylphenylethyl Butyrate is a colorless liquid with a slightly herbal, strongly fruity odor,reminiscent of prune and apricot. It is used in perfumery as a modifier of the alcohol and for oriental notes.
Chemical Propertiesα,α-Dimethylphenethyl butyrate has a mild, herbaceous, fruity (plum–prune) odor and an apricot-, peach-, plum-like taste
DefinitionChEBI: 2-Methyl-1-phenyl-2-propanyl butyrate is an alkylbenzene.
Safety ProfileLow oral toxicity. A skin irritant.When heated to decomposition it emits acrid smoke andirritating fumes.
Benzyldimethylcarbinyl butyrate Preparation Products And Raw materials
Raw materialsButyric Acid-->2-Methyl-1-phenyl-2-propanol
α,α-dimethylbutyric acid 2-Methyl-1-phenyl-2-propanol 2,2-Dimethylbutyric acid Dimethylbenzylcarbinyl acetate 3,3-Dimethylbutyric acid Benzyl chloride Benzyltriethylammonium chloride (R)-Glycidyl butyrate Butyric Acid Phenylacetone Sucrose acetate isobutyrate α-Lipoic Acid Tributyrin Benzyldimethylcarbinyl butyrate Benzyl bromide N,N-Dimethylbenzylamine DIBENZYLTOLUENE Diethylstilbestrol
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