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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H8O3
Molecular Weight 152.1473
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-HYDROXY-O-TOLUIC ACID

SMILES

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

InChI

InChIKey=BBMFSGOFUHEVNP-UHFFFAOYSA-N
InChI=1S/C8H8O3/c1-5-4-6(9)2-3-7(5)8(10)11/h2-4,9H,1H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C8H8O3
Molecular Weight 152.1473
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 18:21:05 GMT 2023
Edited
by admin
on Sat Dec 16 18:21:05 GMT 2023
Record UNII
U4NMG5AH8R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-HYDROXY-O-TOLUIC ACID
Systematic Name English
NSC-85496
Code English
2-METHYL-4-HYDROXYBENZOIC ACID
Systematic Name English
4-HYDROXY-2-METHYLBENZOIC ACID
Systematic Name English
BENZOIC ACID, 4-HYDROXY-2-METHYL-
Systematic Name English
4,2-CRESOTIC ACID
Common Name English
Code System Code Type Description
FDA UNII
U4NMG5AH8R
Created by admin on Sat Dec 16 18:21:05 GMT 2023 , Edited by admin on Sat Dec 16 18:21:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID10206490
Created by admin on Sat Dec 16 18:21:05 GMT 2023 , Edited by admin on Sat Dec 16 18:21:05 GMT 2023
PRIMARY
NSC
85496
Created by admin on Sat Dec 16 18:21:05 GMT 2023 , Edited by admin on Sat Dec 16 18:21:05 GMT 2023
PRIMARY
PUBCHEM
68475
Created by admin on Sat Dec 16 18:21:05 GMT 2023 , Edited by admin on Sat Dec 16 18:21:05 GMT 2023
PRIMARY
CAS
578-39-2
Created by admin on Sat Dec 16 18:21:05 GMT 2023 , Edited by admin on Sat Dec 16 18:21:05 GMT 2023
PRIMARY
ECHA (EC/EINECS)
209-422-1
Created by admin on Sat Dec 16 18:21:05 GMT 2023 , Edited by admin on Sat Dec 16 18:21:05 GMT 2023
PRIMARY