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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H13N
Molecular Weight 135.2062
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-ISOPROPYLANILINE

SMILES

CC(C)C1=CC=CC=C1N

InChI

InChIKey=YKOLZVXSPGIIBJ-UHFFFAOYSA-N
InChI=1S/C9H13N/c1-7(2)8-5-3-4-6-9(8)10/h3-7H,10H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
2-ISOPROPYLANILINE
Systematic Name English
2-(1-METHYLETHYL)BENZENAMINE
Preferred Name English
ANILINE, O-ISOPROPYL-
Systematic Name English
BENZENAMINE, 2-(1-METHYLETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
BN8UZ4TE5F
Created by admin on Tue Apr 01 19:24:15 GMT 2025 , Edited by admin on Tue Apr 01 19:24:15 GMT 2025
PRIMARY
CAS
643-28-7
Created by admin on Tue Apr 01 19:24:15 GMT 2025 , Edited by admin on Tue Apr 01 19:24:15 GMT 2025
PRIMARY
EPA CompTox
DTXSID6052328
Created by admin on Tue Apr 01 19:24:15 GMT 2025 , Edited by admin on Tue Apr 01 19:24:15 GMT 2025
PRIMARY
ECHA (EC/EINECS)
211-397-7
Created by admin on Tue Apr 01 19:24:15 GMT 2025 , Edited by admin on Tue Apr 01 19:24:15 GMT 2025
PRIMARY
PUBCHEM
12561
Created by admin on Tue Apr 01 19:24:15 GMT 2025 , Edited by admin on Tue Apr 01 19:24:15 GMT 2025
PRIMARY