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

Details

Stereochemistry ACHIRAL
Molecular Formula C4H8N2
Molecular Weight 84.1197
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Aminobutyronitrile

SMILES

NCCCC#N

InChI

InChIKey=XGYKKVTZDQDYJQ-UHFFFAOYSA-N
InChI=1S/C4H8N2/c5-3-1-2-4-6/h1-3,5H2

HIDE SMILES / InChI

Molecular Formula C4H8N2
Molecular Weight 84.1197
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 19:12:01 GMT 2025
Edited
by admin
on Mon Mar 31 19:12:01 GMT 2025
Record UNII
T4WWX9NX8N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Aminobutanenitrile
Preferred Name English
4-Aminobutyronitrile
Systematic Name English
Butyronitrile, 4-amino-
Systematic Name English
?-Aminobutyronitrile
Systematic Name English
Butanenitrile, 4-amino-
Systematic Name English
Code System Code Type Description
PUBCHEM
122953
Created by admin on Mon Mar 31 19:12:01 GMT 2025 , Edited by admin on Mon Mar 31 19:12:01 GMT 2025
PRIMARY
EPA CompTox
DTXSID70186426
Created by admin on Mon Mar 31 19:12:01 GMT 2025 , Edited by admin on Mon Mar 31 19:12:01 GMT 2025
PRIMARY
CAS
32754-99-7
Created by admin on Mon Mar 31 19:12:01 GMT 2025 , Edited by admin on Mon Mar 31 19:12:01 GMT 2025
PRIMARY
FDA UNII
T4WWX9NX8N
Created by admin on Mon Mar 31 19:12:01 GMT 2025 , Edited by admin on Mon Mar 31 19:12:01 GMT 2025
PRIMARY
ECHA (EC/EINECS)
251-199-8
Created by admin on Mon Mar 31 19:12:01 GMT 2025 , Edited by admin on Mon Mar 31 19:12:01 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT