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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7IO2
Molecular Weight 262.0445
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Iodo-2-methylbenzoic acid

SMILES

CC1=C(C=C(I)C=C1)C(O)=O

InChI

InChIKey=WUBHOZQZSHGUFI-UHFFFAOYSA-N
InChI=1S/C8H7IO2/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4H,1H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C8H7IO2
Molecular Weight 262.0445
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 19:56:40 GMT 2023
Edited
by admin
on Sat Dec 16 19:56:40 GMT 2023
Record UNII
TZR47NR9ZG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Iodo-2-methylbenzoic acid
Systematic Name English
Benzoic acid, 5-iodo-2-methyl-
Systematic Name English
2-Methyl-5-iodobenzoic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
621745
Created by admin on Sat Dec 16 19:56:40 GMT 2023 , Edited by admin on Sat Dec 16 19:56:40 GMT 2023
PRIMARY
CAS
54811-38-0
Created by admin on Sat Dec 16 19:56:40 GMT 2023 , Edited by admin on Sat Dec 16 19:56:40 GMT 2023
PRIMARY
FDA UNII
TZR47NR9ZG
Created by admin on Sat Dec 16 19:56:40 GMT 2023 , Edited by admin on Sat Dec 16 19:56:40 GMT 2023
PRIMARY