ETHYL VALERATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H14O2
Molecular Weight	130.1849
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCC(=O)OCC

InChI

InChIKey=ICMAFTSLXCXHRK-UHFFFAOYSA-N

InChI=1S/C7H14O2/c1-3-5-6-7(8)9-4-2/h3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C7H14O2
Molecular Weight	130.1849
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/22378626

Ethyl valerate is a substance responsible for green apple flavor. It has various applications in the food and cosmetic industry.

Approval Year

Conditions

Condition	Modality	Targets	Highest Phase	Product
Unknown 2578

PubMed

Title	Date	PubMed
Conformational analysis of green apple flavour: the gas-phase structure of ethyl valerate validated by microwave spectroscopy.	2012 Apr 10	22378626

Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:50:36 GMT 2023` Edited by `admin` on `Fri Dec 15 16:50:36 GMT 2023`
Record UNII	95R258T4P6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETHYL VALERATE

Systematic Name

English

ETHYL N-PENTANOATE

Common Name

English

N-VALERIC ACID ETHYL ESTER

Common Name

English

NSC-8868

Code

English

ETHYL VALERATE [FHFI]

Common Name

English

PENTANOIC ACID, ETHYL ESTER

Common Name

English

VALERIC ACID, ETHYL ESTER

Common Name

English

ETHYL VALERATE [FCC]

Common Name

English

VALERIC ACID ETHYL ESTER

Systematic Name

English

ETHYLVALERATE

Common Name

English

AMYLMETACRESOL IMPURITY H [EP IMPURITY]

Common Name

English

FEMA NO. 2462

Code

English

N-VALERIC ACID ETHYL ESTER [MI]

Common Name

English

Classification Tree Code System Code

CFR

21 CFR 172.515