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Details

Stereochemistry ACHIRAL
Molecular Formula C8H8N2
Molecular Weight 132.1625
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Aminophenylacetonitrile

SMILES

NC1=CC=C(CC#N)C=C1

InChI

InChIKey=YCWRFIYBUQBHJI-UHFFFAOYSA-N
InChI=1S/C8H8N2/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5,10H2

HIDE SMILES / InChI

Molecular Formula C8H8N2
Molecular Weight 132.1625
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 Wed Apr 02 10:12:34 GMT 2025
Edited
by admin
on Wed Apr 02 10:12:34 GMT 2025
Record UNII
T5MPS6H2QG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4-Aminophenyl)acetonitrile
Preferred Name English
4-Aminophenylacetonitrile
Systematic Name English
(p-Aminophenyl)acetonitrile
Systematic Name English
Benzeneacetonitrile, 4-amino-
Systematic Name English
4-Aminobenzeneacetonitrile
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
222-587-4
Created by admin on Wed Apr 02 10:12:35 GMT 2025 , Edited by admin on Wed Apr 02 10:12:35 GMT 2025
PRIMARY
PUBCHEM
77000
Created by admin on Wed Apr 02 10:12:35 GMT 2025 , Edited by admin on Wed Apr 02 10:12:35 GMT 2025
PRIMARY
EPA CompTox
DTXSID50188923
Created by admin on Wed Apr 02 10:12:35 GMT 2025 , Edited by admin on Wed Apr 02 10:12:35 GMT 2025
PRIMARY
FDA UNII
T5MPS6H2QG
Created by admin on Wed Apr 02 10:12:35 GMT 2025 , Edited by admin on Wed Apr 02 10:12:35 GMT 2025
PRIMARY
CAS
3544-25-0
Created by admin on Wed Apr 02 10:12:35 GMT 2025 , Edited by admin on Wed Apr 02 10:12:35 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT