ChemicalBook--->CAS DataBase List--->25415-67-2

25415-67-2

25415-67-2 Structure

25415-67-2 Structure
IdentificationBack Directory
[Name]

ETHYL 4-METHYLVALERATE
[CAS]

25415-67-2
[Synonyms]

ETHYL ISOCAPROATE
Ethyl isohexanoate
ETHYL 4-METHYLVALERATE
ETHYL 4-METHYLPENTANOATE
4-methyl-pentanoicaciethylester
4-Methylvaleric acid ethyl ester
4-Methylpentanoic acid ethyl ester
Ethyl 4-methylvalerate >=97.0% (GC)
Valeric acid, 4-methyl-, ethyl ester
Pentanoic acid, 4-methyl-, ethyl ester
Ethyl 4-methylpentanoate, Ethyl isocaproate
ethylisohexanoate,4-methylpentanoicacidethylester
[EINECS(EC#)]

246-955-9
[Molecular Formula]

C8H16O2
[MDL Number]

MFCD00042887
[MOL File]

25415-67-2.mol
[Molecular Weight]

144.21
Chemical PropertiesBack Directory
[Melting point ]

-67°C (estimate)
[Boiling point ]

159-160 °C (lit.)
[density ]

0.868 g/mL at 20 °C (lit.)
[FEMA ]

4343 | ETHYL 4-METHYLPENTANOATE
[refractive index ]

n20/D 1.406
[Fp ]

43 °C
[storage temp. ]

Sealed in dry,Room Temperature
[Appearance]

Colorless to light yellow Liquid
[Odor]

fruity
[JECFA Number]

2283
[BRN ]

1747377
[InChI]

1S/C8H16O2/c1-4-10-8(9)6-5-7(2)3/h7H,4-6H2,1-3H3
[InChIKey]

OFQRUTMGVBMTFQ-UHFFFAOYSA-N
[SMILES]

CCOC(=O)CCC(C)C
[LogP]

2.65
[EPA Substance Registry System]

Pentanoic acid, 4-methyl-, ethyl ester (25415-67-2)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)
GHS02
[Signal word ]

Warning
[Hazard statements ]

H225
[Precautionary statements ]

P210-P403+P235
[Risk Statements ]

10
[RIDADR ]

UN 3272 3/PG 3
[WGK Germany ]

3
[TSCA ]

TSCA listed
[HazardClass ]

3.2
[PackingGroup ]

III
[HS Code ]

2915907098
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Flam. Liq. 3
Hazard InformationBack Directory
[Chemical Properties]

Colorless clear liquid; fruity aroma.
[Uses]

4-Methylvaleric Acid Ethyl-d5 Ester is the labeled analogue of 4-Methylvaleric Acid Ethyl Ester (M338500), which is aroma component of red wine, Chinese Moutai and Langjiu liquors and cashew apple juice (Anacardium occidentale L.).
[Definition]

ChEBI: Ethyl 4-methylpentanoate is a fatty acid ester.
[Aroma threshold values]

Medium strength odor.
Spectrum DetailBack Directory
[Spectrum Detail]

ETHYL 4-METHYLVALERATE(25415-67-2)1HNMR
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