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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H8O4
Molecular Weight 180.1574
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-METHYLISOPHTHALIC ACID

SMILES

CC1=CC(=CC(=C1)C(O)=O)C(O)=O

InChI

InChIKey=PMZBHPUNQNKBOA-UHFFFAOYSA-N
InChI=1S/C9H8O4/c1-5-2-6(8(10)11)4-7(3-5)9(12)13/h2-4H,1H3,(H,10,11)(H,12,13)

HIDE SMILES / InChI

Approval Year

Name Type Language
5-METHYLISOPHTHALIC ACID
Systematic Name English
Uvitic acid
Common Name English
NSC-41436
Code English
Isophthalic acid, 5-methyl-
Systematic Name English
1,3-Benzenedicarboxylic acid, 5-methyl-
Systematic Name English
Code System Code Type Description
WIKIPEDIA
Uvitic acid
Created by admin on Sat Dec 16 12:33:56 GMT 2023 , Edited by admin on Sat Dec 16 12:33:56 GMT 2023
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EPA CompTox
DTXSID50198143
Created by admin on Sat Dec 16 12:33:56 GMT 2023 , Edited by admin on Sat Dec 16 12:33:56 GMT 2023
PRIMARY
FDA UNII
L828A4V3R6
Created by admin on Sat Dec 16 12:33:56 GMT 2023 , Edited by admin on Sat Dec 16 12:33:56 GMT 2023
PRIMARY
PUBCHEM
68137
Created by admin on Sat Dec 16 12:33:56 GMT 2023 , Edited by admin on Sat Dec 16 12:33:56 GMT 2023
PRIMARY
CAS
499-49-0
Created by admin on Sat Dec 16 12:33:56 GMT 2023 , Edited by admin on Sat Dec 16 12:33:56 GMT 2023
PRIMARY
NSC
41436
Created by admin on Sat Dec 16 12:33:56 GMT 2023 , Edited by admin on Sat Dec 16 12:33:56 GMT 2023
PRIMARY
ECHA (EC/EINECS)
207-881-2
Created by admin on Sat Dec 16 12:33:56 GMT 2023 , Edited by admin on Sat Dec 16 12:33:56 GMT 2023
PRIMARY