ISOBUTYL 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 ISOBUTYL VALERATE

Structure Search

SMILES

CCCCC(=O)OCC(C)C

InChI

InChIKey=ADNADZOSMJDVIS-UHFFFAOYSA-N

InChI=1S/C9H18O2/c1-4-5-6-9(10)11-7-8(2)3/h8H,4-7H2,1-3H3

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 `Sat Dec 16 10:08:31 GMT 2023` Edited by `admin` on `Sat Dec 16 10:08:31 GMT 2023`
Record UNII	9N1Y3169HV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOBUTYL VALERATE

Systematic Name

English

VALERIC ACID, ISOBUTYL ESTER

Common Name

English

ISOBUTYL PENTANOATE

Systematic Name

English

2-METHYLPROPYL VALERATE

Systematic Name

English

ISOBUTYL VALERINATE

Common Name

English

2-METHYL-1-PROPYL PENTANOATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

66356

Created by admin on Sat Dec 16 10:08:31 GMT 2023 , Edited by admin on Sat Dec 16 10:08:31 GMT 2023

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FDA UNII

9N1Y3169HV

Created by admin on Sat Dec 16 10:08:31 GMT 2023 , Edited by admin on Sat Dec 16 10:08:31 GMT 2023

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EPA CompTox

DTXSID1065134

Created by admin on Sat Dec 16 10:08:31 GMT 2023 , Edited by admin on Sat Dec 16 10:08:31 GMT 2023

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CAS

10588-10-0

Created by admin on Sat Dec 16 10:08:31 GMT 2023 , Edited by admin on Sat Dec 16 10:08:31 GMT 2023

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ECHA (EC/EINECS)

234-191-9

Created by admin on Sat Dec 16 10:08:31 GMT 2023 , Edited by admin on Sat Dec 16 10:08:31 GMT 2023

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