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Details

Stereochemistry ACHIRAL
Molecular Formula C11H14N2
Molecular Weight 174.2423
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Isopropylamino-4-methylbenzonitrile

SMILES

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

InChI

InChIKey=HVKRBGJBJXDAGA-UHFFFAOYSA-N
InChI=1S/C11H14N2/c1-8(2)13-11-6-9(3)4-5-10(11)7-12/h4-6,8,13H,1-3H3

HIDE SMILES / InChI

Molecular Formula C11H14N2
Molecular Weight 174.2423
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 18:49:37 GMT 2025
Edited
by admin
on Tue Apr 01 18:49:37 GMT 2025
Record UNII
SCW2HD5E4J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Methyl-2-[(1-methylethyl)amino]benzonitrile
Preferred Name English
2-Isopropylamino-4-methylbenzonitrile
Systematic Name English
Benzonitrile, 4-methyl-2-[(1-methylethyl)amino]-
Systematic Name English
Code System Code Type Description
PUBCHEM
119887
Created by admin on Tue Apr 01 18:49:37 GMT 2025 , Edited by admin on Tue Apr 01 18:49:37 GMT 2025
PRIMARY
CAS
28195-00-8
Created by admin on Tue Apr 01 18:49:37 GMT 2025 , Edited by admin on Tue Apr 01 18:49:37 GMT 2025
PRIMARY
ECHA (EC/EINECS)
248-892-2
Created by admin on Tue Apr 01 18:49:37 GMT 2025 , Edited by admin on Tue Apr 01 18:49:37 GMT 2025
PRIMARY
EPA CompTox
DTXSID10182462
Created by admin on Tue Apr 01 18:49:37 GMT 2025 , Edited by admin on Tue Apr 01 18:49:37 GMT 2025
PRIMARY
FDA UNII
SCW2HD5E4J
Created by admin on Tue Apr 01 18:49:37 GMT 2025 , Edited by admin on Tue Apr 01 18:49:37 GMT 2025
PRIMARY