U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H10N2
Molecular Weight 146.1891
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ANILINOPROPIONITRILE

SMILES

N#CCCNC1=CC=CC=C1

InChI

InChIKey=FENJKTQEFUPECW-UHFFFAOYSA-N
InChI=1S/C9H10N2/c10-7-4-8-11-9-5-2-1-3-6-9/h1-3,5-6,11H,4,8H2

HIDE SMILES / InChI

Molecular Formula C9H10N2
Molecular Weight 146.1891
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 Tue Apr 01 16:57:40 GMT 2025
Edited
by admin
on Tue Apr 01 16:57:40 GMT 2025
Record UNII
S4YM38H4U6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-80663
Preferred Name English
3-ANILINOPROPIONITRILE
Systematic Name English
PROPIONITRILE, 3-ANILINO-
Systematic Name English
3-(PHENYLAMINO)PROPANENITRILE
Systematic Name English
(.BETA.-CYANOETHYL)ANILINE
Systematic Name English
.BETA.-ANILINOPROPIONITRILE
Systematic Name English
PROPANENITRILE, 3-(PHENYLAMINO)-
Systematic Name English
N-(CYANOETHYL)ANILINE
Systematic Name English
N-(2-CYANOETHYL)ANILINE
Systematic Name English
3-(PHENYLAMINO)PROPIONITRILE
Systematic Name English
3-(N-PHENYLAMINO)PROPIONITRILE
Systematic Name English
3-ANILINOPROPANENITRILE
Systematic Name English
N-(.BETA.-CYANOETHYL)ANILINE
Systematic Name English
Code System Code Type Description
FDA UNII
S4YM38H4U6
Created by admin on Tue Apr 01 16:57:40 GMT 2025 , Edited by admin on Tue Apr 01 16:57:40 GMT 2025
PRIMARY
ECHA (EC/EINECS)
214-057-6
Created by admin on Tue Apr 01 16:57:40 GMT 2025 , Edited by admin on Tue Apr 01 16:57:40 GMT 2025
PRIMARY
NSC
80663
Created by admin on Tue Apr 01 16:57:40 GMT 2025 , Edited by admin on Tue Apr 01 16:57:40 GMT 2025
PRIMARY
EPA CompTox
DTXSID8051548
Created by admin on Tue Apr 01 16:57:40 GMT 2025 , Edited by admin on Tue Apr 01 16:57:40 GMT 2025
PRIMARY
CAS
1075-76-9
Created by admin on Tue Apr 01 16:57:40 GMT 2025 , Edited by admin on Tue Apr 01 16:57:40 GMT 2025
PRIMARY
PUBCHEM
14100
Created by admin on Tue Apr 01 16:57:40 GMT 2025 , Edited by admin on Tue Apr 01 16:57:40 GMT 2025
PRIMARY