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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H10O2
Molecular Weight 150.1745
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,5-DIMETHYL-BENZOIC ACID

SMILES

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

InChI

InChIKey=XZRHNAFEYMSXRG-UHFFFAOYSA-N
InChI=1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents
Name Type Language
2,5-DIMETHYL-BENZOIC ACID
Systematic Name English
BENZOIC ACID, 2,5-DIMETHYL-
Common Name English
Code System Code Type Description
PUBCHEM
11892
Created by admin on Fri Dec 15 20:01:25 GMT 2023 , Edited by admin on Fri Dec 15 20:01:25 GMT 2023
PRIMARY
CAS
610-72-0
Created by admin on Fri Dec 15 20:01:25 GMT 2023 , Edited by admin on Fri Dec 15 20:01:25 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-235-2
Created by admin on Fri Dec 15 20:01:25 GMT 2023 , Edited by admin on Fri Dec 15 20:01:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID2060591
Created by admin on Fri Dec 15 20:01:25 GMT 2023 , Edited by admin on Fri Dec 15 20:01:25 GMT 2023
PRIMARY
FDA UNII
RKE5PMK0H6
Created by admin on Fri Dec 15 20:01:25 GMT 2023 , Edited by admin on Fri Dec 15 20:01:25 GMT 2023
PRIMARY