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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H8O2
Molecular Weight 136.1479
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-TOLUIC ACID

SMILES

CC1=CC=CC=C1C(O)=O

InChI

InChIKey=ZWLPBLYKEWSWPD-UHFFFAOYSA-N
InChI=1S/C8H8O2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3,(H,9,10)

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Regulation of methylbenzoate emission after pollination in snapdragon and petunia flowers.
2003 Dec
Effects of the headspace gas composition on anaerobic biotransformation of o-, m-, and p-toluic acid in sediment slurries.
2003 Jun
Nucleophile selectivity in the acyl transfer reaction of a designed enzyme.
2005 Dec 15
Influence of sodium benzoate on the metabolism of o-xylene in the rat.
2005 May
Ethylene-regulated floral volatile synthesis in petunia corollas.
2005 May
Photoionization of atmospheric aerosol constituents and precursors in the 7-15 eV energy region: experimental and theoretical study.
2008 Jun 12
Tetra-kis(μ-2-methyl-benzoato)bis-[(2-methyl-benzoic acid)copper(II)].
2008 Mar 14
Structure-composition relationships in ternary solvents containing methylbenzoate.
2008 Mar 20
Flavour compounds in tomato fruits: identification of loci and potential pathways affecting volatile composition.
2009
catena-Poly[[trimethyltin(IV)]-μ-2-methylbenzoato-κO:O'].
2009 Dec 4
Comparative morphology of the axial complex and interdependence of internal organ systems in sea urchins (Echinodermata: Echinoidea).
2009 Jun 9
Anatomical branches of the superior rectal artery in the distal rectum.
2009 Nov
Tetra-kis(μ-2-methyl-benzoato-κO:O')bis-[(methanol-κO)copper(II)].
2010 Apr 17
Chloridotris[μ(2)-2-(dimethyl-amino)-ethano-lato]-μ(3)-hydroxido-tri-μ(2)-trifluoro-acetato-tetra-copper(II) tetra-hydro-furan solvate.
2010 Jun 18
LiCl-Promoted Pd(II)-catalyzed ortho carbonylation of N,N-dimethylbenzylamines.
2010 Nov 21
Inhibition of Hsp90 with resorcylic acid macrolactones: synthesis and binding studies.
2010 Sep 10
Patents
Name Type Language
O-TOLUIC ACID
MI  
Common Name English
NSC-2193
Code English
2-METHYLBENZOIC ACID
Systematic Name English
TOLUIC ACID, O-
Common Name English
BENZOIC ACID, 2-METHYL-
Common Name English
O-METHYLBENZOIC ACID
Systematic Name English
O-TOLUIC ACID [MI]
Common Name English
2-TOLUIC ACID
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
204-284-9
Created by admin on Fri Dec 15 18:14:16 GMT 2023 , Edited by admin on Fri Dec 15 18:14:16 GMT 2023
PRIMARY
CHEBI
36632
Created by admin on Fri Dec 15 18:14:16 GMT 2023 , Edited by admin on Fri Dec 15 18:14:16 GMT 2023
PRIMARY
WIKIPEDIA
O-TOLUIC ACID
Created by admin on Fri Dec 15 18:14:16 GMT 2023 , Edited by admin on Fri Dec 15 18:14:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID6026161
Created by admin on Fri Dec 15 18:14:16 GMT 2023 , Edited by admin on Fri Dec 15 18:14:16 GMT 2023
PRIMARY
FDA UNII
9NR3033Y0U
Created by admin on Fri Dec 15 18:14:16 GMT 2023 , Edited by admin on Fri Dec 15 18:14:16 GMT 2023
PRIMARY
CAS
118-90-1
Created by admin on Fri Dec 15 18:14:16 GMT 2023 , Edited by admin on Fri Dec 15 18:14:16 GMT 2023
PRIMARY
PUBCHEM
8373
Created by admin on Fri Dec 15 18:14:16 GMT 2023 , Edited by admin on Fri Dec 15 18:14:16 GMT 2023
PRIMARY
MERCK INDEX
m10965
Created by admin on Fri Dec 15 18:14:16 GMT 2023 , Edited by admin on Fri Dec 15 18:14:16 GMT 2023
PRIMARY Merck Index
NSC
2193
Created by admin on Fri Dec 15 18:14:16 GMT 2023 , Edited by admin on Fri Dec 15 18:14:16 GMT 2023
PRIMARY