ChemicalBook--->CAS DataBase List--->24817-51-4

24817-51-4

24817-51-4 Structure

24817-51-4 Structure
IdentificationBack Directory
[Name]

FEMA 3632
[CAS]

24817-51-4
[Synonyms]

ANATOLYL
FEMA 3632
rose butanoate
exyl octanoate
FEMA 3632 USP/EP/BP
Phenethyl2-Methylbutanoate
PHENETHYL 2-METHYLBUTYRATE
PHENYLETHYL-2-METHYLBUTYRAT
2-Phenethyl-2-methylbutyrate
PHENYLETHYL-2-METHYLBUTYRATE
Phenethyl2-methylbutyrate(N)
Phenylethyl 2-methylbutanoate
2-Phenylethyl-2-methylbutyrat
benzylcarbinyl2-methylbutyrate
2-PHENYLETHYL 2-METHYLBUTYRATE
2-phenylethyl 2-methylbutanoate
2-methyl-butyricaciphenethylester
beta-Phenylethyl 2-methylbutyrate
2-methyl-butyric aci phenethyl este
PHENYLETHYL-2-METHYLBUTYRATE, NATURAL
PHENETHYL 2-METHYLBUTYRATE 95+% FCC
beta-phenylethylalpha-methylbutanoate
2-methyl-butanoicaci2-phenylethylester
Benzyl carbinyl ethyl methyl acetate
Butanoicacid,2-methyl-,2-phenylethylester
Phenethyl 2-methylbutyrate >=95%, FCC, FG
2-Methylbutanoic acid, 2-phenylethyl ester
[EINECS(EC#)]

246-476-5
[Molecular Formula]

C13H18O2
[MDL Number]

MFCD00061557
[MOL File]

24817-51-4.mol
[Molecular Weight]

206.28
Chemical PropertiesBack Directory
[Boiling point ]

305.14°C (rough estimate)
[density ]

0.975 g/mL at 25 °C(lit.)
[FEMA ]

3632 | PHENYLETHYL 2-METHYLBUTYRATE
[refractive index ]

n20/D 1.486(lit.)
[Fp ]

>230 °F
[solubility ]

Practically insoluble in water, soluble in alcohol and oils
[Odor]

Sweet floral and fruity odor
[biological source]

synthetic
[Odor Type]

floral
[JECFA Number]

993
[Major Application]

flavors and fragrances
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

InChI=1S/C13H18O2/c1-3-11(2)13(14)15-10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3
[InChIKey]

KVKKTLBBYFABAZ-UHFFFAOYSA-N
[SMILES]

C(OCCC1=CC=CC=C1)(=O)C(C)CC
[LogP]

3.71
[EPA Substance Registry System]

2-Phenylethyl 2-methylbutyrate (24817-51-4)
Safety DataBack Directory
[WGK Germany ]

2
[RTECS ]

EK7902510
[TSCA ]

TSCA listed
[Storage Class]

10 - Combustible liquids
[Toxicity]

LD50 orl-rat: >5 g/kg FCTOD7 26,399,88
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Phenethyl alcohol-->2-Methyl butyric acid
Hazard InformationBack Directory
[Chemical Properties]

Phenethyl-2-methylbutyrate has a sweet, floral, fruity odor with warm, herbaceous notes; the flavor is sweet and slightly fruity
[Occurrence]

Reported found in mint.
[Uses]

FEMA 3632 has found some use in flavor compositions, mainly in imitation Peppermint, which is still a very difficult problem in spite of intense and very fruitful research into that oil.
[Preparation]

By esterification of phenethyl alcohol with α-methylbutyric acid.
[Taste threshold values]

Taste characteristics at 30 ppm: fruity, floral, green sweet and waxy.
[Safety Profile]

Low toxicity by ingestion and skin contact. When heated to decomposition it emits acrid smoke and irritating vapors.
Spectrum DetailBack Directory
[Spectrum Detail]

FEMA 3632(24817-51-4)1HNMR
FEMA 3632(24817-51-4)FT-IR
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