ISOVALERONITRILE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H9N
Molecular Weight	83.1317
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)CC#N

InChI

InChIKey=QHDRKFYEGYYIIK-UHFFFAOYSA-N

InChI=1S/C5H9N/c1-5(2)3-4-6/h5H,3H2,1-2H3

HIDE SMILES / InChI

Approval Year

PubMed

Title	Date	PubMed
Novel catalytic activity of nitrile hydratase from Rhodococcus sp. N771.	2008 Aug	18804061
Metabolic characterization of loci affecting sensory attributes in tomato allows an assessment of the influence of the levels of primary metabolites and volatile organic contents.	2009	19346240

Name

Type

Language

ISOVALERONITRILE

Systematic Name

English

NSC-148363

Code

English

3-METHYLBUTYRONITRILE

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

210-884-1

Created by admin on Fri Dec 15 19:37:14 GMT 2023 , Edited by admin on Fri Dec 15 19:37:14 GMT 2023

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PUBCHEM

12244

Created by admin on Fri Dec 15 19:37:15 GMT 2023 , Edited by admin on Fri Dec 15 19:37:15 GMT 2023

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NSC

148363

Created by admin on Fri Dec 15 19:37:15 GMT 2023 , Edited by admin on Fri Dec 15 19:37:15 GMT 2023

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EPA CompTox

DTXSID0021620

Created by admin on Fri Dec 15 19:37:14 GMT 2023 , Edited by admin on Fri Dec 15 19:37:14 GMT 2023

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FDA UNII

N2G72X091L

Created by admin on Fri Dec 15 19:37:14 GMT 2023 , Edited by admin on Fri Dec 15 19:37:14 GMT 2023

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CAS

625-28-5

Created by admin on Fri Dec 15 19:37:14 GMT 2023 , Edited by admin on Fri Dec 15 19:37:14 GMT 2023

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MESH

C403810

Created by admin on Fri Dec 15 19:37:15 GMT 2023 , Edited by admin on Fri Dec 15 19:37:15 GMT 2023

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SUBSTANCE RECORD


					N2G72X091L

ISOVALERONITRILE