ChemicalBook--->CAS DataBase List--->10094-34-5

10094-34-5

10094-34-5 Structure

10094-34-5 Structure
IdentificationMore
[Name]

Benzyldimethylcarbinyl butyrate
[CAS]

10094-34-5
[Synonyms]

A A-DIMETHYLPHENETHYL N-BUTYRATE
ALPHA,ALPHA-DIMETHYLPHENETHYL BUTYRATE
Benzyldimethylcarbinyl butyrate
DIMETHYL BENZYL CARBINYL BUTYRATE
DIMETHYLBENZYLCARBINYL N-BUTYRATE
FEMA 2394
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
benzyldimethylcarbinyln-butyrate
Butanoic acid, 1,1-dimethyl-2-phenylethyl ester
Butanoicacid,1,1-dimethyl-2-phenylethylester
Butyric acid, alpha,alpha-dimethylphenethyl ester
butyricacid,alpha,alpha-dimethylphenethylester
ALPHA ALPHA-DIMETHLPHENETHYL BUTYRATE &
α,α-Dimethylphenethyl butyrate
alpha,alpha-Dimethylphenethylbutyrat
[EINECS(EC#)]

233-221-8
[Molecular Formula]

C14H20O2
[MDL Number]

MFCD00027132
[Molecular Weight]

220.31
[MOL File]

10094-34-5.mol
Chemical PropertiesBack Directory
[Boiling point ]

237-255 °C(lit.)
[density ]

0.969 g/mL at 25 °C(lit.)
[vapor pressure ]

0.164Pa at 20℃
[FEMA ]

2394
[refractive index ]

n20/D 1.4839(lit.)
[Fp ]

>230 °F
[color ]

Colorless liquid
[Specific Gravity]

0.96
[Odor]

plum aroma
[biological source]

synthetic
[Odor Type]

floral
[Water Solubility ]

16.11mg/L at 20℃
[JECFA Number]

1656
[Major Application]

flavors and fragrances
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C14H20O2/c1-4-8-13(15)16-14(2,3)11-12-9-6-5-7-10-12/h5-7,9-10H,4,8,11H2,1-3H3
[InChIKey]

SHSGYHAHMQLYRB-UHFFFAOYSA-N
[SMILES]

CCCC(=O)OC(C)(C)Cc1ccccc1
[LogP]

4.7 at 25℃
[CAS DataBase Reference]

10094-34-5(CAS DataBase Reference)
[NIST Chemistry Reference]

Butanoic acid, 1,1-dimethyl-2-phenylethyl ester(10094-34-5)
[EPA Substance Registry System]

10094-34-5(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H412
[Precautionary statements ]

P273-P302+P352
[Hazard Codes ]

Xi
[Risk Statements ]

R38:Irritating to the skin.
R43:May cause sensitization by skin contact.
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S36/37:Wear suitable protective clothing and gloves .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN3082 9/PG 3
[WGK Germany ]

2
[RTECS ]

ET0130000
[TSCA ]

TSCA listed
[REACH Registrations]

Active
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Aquatic Chronic 3
Skin Irrit. 2
[Toxicity]

LD50 orl-rat: >5 g/kg FCTXAV 18,667,80
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Butyric Acid-->2-Methyl-1-phenyl-2-propanol
Hazard InformationBack Directory
[Chemical Properties]

colorless liquid
[Chemical Properties]

α,α-Dimethylphenethyl butyrate has a mild, herbaceous, fruity (plum–prune) odor and an apricot-, peach-, plum-like taste
[Chemical Properties]

α,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.
[Uses]

Benzyldimethylcarbinyl butyrate is used in perfume compositions of the Oriental-Rose, Chypre, Peony and other types, often as a modifier for other D. M.B.C. esters.
[Definition]

ChEBI: 2-Methyl-1-phenyl-2-propanyl butyrate is an alkylbenzene.
[Safety Profile]

Low oral toxicity. A skin irritant.When heated to decomposition it emits acrid smoke andirritating fumes.
[Synthesis]

Benzyldimethylcarbinyl butyrate is prepared by direct esterification of Dimethyl benzylcarbinol with n-Butyric acid, using a catalyst and preferably azeotropic conditions.
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

10094-34-5(sigmaaldrich)
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