2-PROPYLVALERONITRILE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H15N
Molecular Weight	125.2114
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-PROPYLVALERONITRILE

Structure Search

SMILES

CCCC(CCC)C#N

InChI

InChIKey=YCBOPMITSGZJDX-UHFFFAOYSA-N

InChI=1S/C8H15N/c1-3-5-8(7-9)6-4-2/h8H,3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C8H15N
Molecular Weight	125.2114
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 `Mon Mar 31 22:56:37 GMT 2025` Edited by `admin` on `Mon Mar 31 22:56:37 GMT 2025`
Record UNII	HTD29QGA4I
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2-PROPYLVALERONITRILE

Systematic Name

English

VALPROIC ACID IMPURITY I [EP IMPURITY]

Preferred Name

English

2-PROPYLPENTANENITRILE

Systematic Name

English

DIPROPYLACETONITRILE

Systematic Name

English

PENTANENITRILE, 2-PROPYL-

Systematic Name

English

4-CYANOHEPTANE

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

236-338-2

Created by admin on Mon Mar 31 22:56:37 GMT 2025 , Edited by admin on Mon Mar 31 22:56:37 GMT 2025

PRIMARY

PUBCHEM

83330

Created by admin on Mon Mar 31 22:56:37 GMT 2025 , Edited by admin on Mon Mar 31 22:56:37 GMT 2025

PRIMARY

CAS

13310-75-3

Created by admin on Mon Mar 31 22:56:37 GMT 2025 , Edited by admin on Mon Mar 31 22:56:37 GMT 2025

PRIMARY

FDA UNII

HTD29QGA4I

Created by admin on Mon Mar 31 22:56:37 GMT 2025 , Edited by admin on Mon Mar 31 22:56:37 GMT 2025

PRIMARY

EPA CompTox

DTXSID70157954

Created by admin on Mon Mar 31 22:56:37 GMT 2025 , Edited by admin on Mon Mar 31 22:56:37 GMT 2025

PRIMARY

Related Record Type Details


					614OI1Z5WI

PARENT -> IMPURITY