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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H8IN
Molecular Weight 233.0496
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Iodo-o-toluidine

SMILES

CC1=CC=C(I)C=C1N

InChI

InChIKey=IOEHXNCBPIBDBZ-UHFFFAOYSA-N
InChI=1S/C7H8IN/c1-5-2-3-6(8)4-7(5)9/h2-4H,9H2,1H3

HIDE SMILES / InChI

Molecular Formula C7H8IN
Molecular Weight 233.0496
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 Sat Dec 16 12:28:15 GMT 2023
Edited
by admin
on Sat Dec 16 12:28:15 GMT 2023
Record UNII
ZFH45ZPW2Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Iodo-o-toluidine
Common Name English
5-Iodo-2-methylbenzenamine
Systematic Name English
5-Iodo-2-methylaniline
Systematic Name English
3-Iodo-6-methylaniline
Systematic Name English
Benzenamine, 5-iodo-2-methyl-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
281-094-2
Created by admin on Sat Dec 16 12:28:15 GMT 2023 , Edited by admin on Sat Dec 16 12:28:15 GMT 2023
PRIMARY
FDA UNII
ZFH45ZPW2Q
Created by admin on Sat Dec 16 12:28:15 GMT 2023 , Edited by admin on Sat Dec 16 12:28:15 GMT 2023
PRIMARY
EPA CompTox
DTXSID50232753
Created by admin on Sat Dec 16 12:28:15 GMT 2023 , Edited by admin on Sat Dec 16 12:28:15 GMT 2023
PRIMARY
CAS
83863-33-6
Created by admin on Sat Dec 16 12:28:15 GMT 2023 , Edited by admin on Sat Dec 16 12:28:15 GMT 2023
PRIMARY
PUBCHEM
522802
Created by admin on Sat Dec 16 12:28:15 GMT 2023 , Edited by admin on Sat Dec 16 12:28:15 GMT 2023
PRIMARY