BUTYL VALERATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H18O2
Molecular Weight	158.238
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BUTYL VALERATE

Structure Search

SMILES

CCCCOC(=O)CCCC

InChI

InChIKey=OKJADYKTJJGKDX-UHFFFAOYSA-N

InChI=1S/C9H18O2/c1-3-5-7-9(10)11-8-6-4-2/h3-8H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C9H18O2
Molecular Weight	158.238
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:42:28 GMT 2023` Edited by `admin` on `Fri Dec 15 18:42:28 GMT 2023`
Record UNII	F93Z6CCM06
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BUTYL VALERATE

Systematic Name

English

BUTYL VALERATE [USP-RS]

Common Name

English

VALERIC ACID, BUTYL ESTER

Common Name

English

BUTYL VALERATE [FHFI]

Common Name

English

N-BUTYL PENTANOATE

Common Name

English

PENTANOIC ACID, BUTYL ESTER

Common Name

English

BUTYL PENTANOATE

Systematic Name

English

N-BUTYL VALERATE

Common Name

English

FEMA NO. 2217

Code

English

Classification Tree Code System Code

JECFA EVALUATION

BUTYL VALERATE

Created by admin on Fri Dec 15 18:42:28 GMT 2023 , Edited by admin on Fri Dec 15 18:42:28 GMT 2023

CFR

21 CFR 172.515

Created by admin on Fri Dec 15 18:42:28 GMT 2023 , Edited by admin on Fri Dec 15 18:42:28 GMT 2023

Code System Code Type Description

EPA CompTox

DTXSID3060455

Created by admin on Fri Dec 15 18:42:28 GMT 2023 , Edited by admin on Fri Dec 15 18:42:28 GMT 2023

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FDA UNII

F93Z6CCM06

Created by admin on Fri Dec 15 18:42:28 GMT 2023 , Edited by admin on Fri Dec 15 18:42:28 GMT 2023

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PUBCHEM

61137

Created by admin on Fri Dec 15 18:42:28 GMT 2023 , Edited by admin on Fri Dec 15 18:42:28 GMT 2023

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RS_ITEM_NUM

1082672

Created by admin on Fri Dec 15 18:42:28 GMT 2023 , Edited by admin on Fri Dec 15 18:42:28 GMT 2023

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JECFA MONOGRAPH

230

Created by admin on Fri Dec 15 18:42:28 GMT 2023 , Edited by admin on Fri Dec 15 18:42:28 GMT 2023

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CAS

591-68-4

Created by admin on Fri Dec 15 18:42:28 GMT 2023 , Edited by admin on Fri Dec 15 18:42:28 GMT 2023

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ECHA (EC/EINECS)

209-728-5

Created by admin on Fri Dec 15 18:42:28 GMT 2023 , Edited by admin on Fri Dec 15 18:42:28 GMT 2023

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