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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 3-METHOXYBENZOIC ACID

SMILES

COC1=CC(=CC=C1)C(O)=O

InChI

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

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

PubMed

PubMed

TitleDatePubMed
Purification and characterization of benzoate-para-hydroxylase, a cytochrome P450 (CYP53A1), from Aspergillus niger.
2001 Oct 15
Toward a better understanding on the mechanism of ortholithiation. Tuning of selectivities in the metalation of meta-anisic acid by an appropriate choice of base.
2005 Jun 9
First general, direct, and regioselective synthesis of substituted methoxybenzoic acids by ortho metalation.
2007 Apr 27
Preparation of lipophilic alkyl (hydroxy)benzoates by solvent-free lipase-catalyzed esterification and transesterification.
2008 Aug
The cobalt way to angucyclinones: asymmetric total synthesis of the antibiotics (+)-rubiginone B2, (-)-tetrangomycin, and (-)-8-O-methyltetrangomycin.
2010 Aug 2
Crystal structure and experimental and theoretical studies of the second-order nonlinear optical properties of salts of triphenylguanidine with carboxylic acids.
2010 Feb 25
Salvadora persica.
2010 Jul
Nematicidal natural products from the aerial parts of Buddleja crispa.
2010 May
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:38:13 UTC 2023
Edited
by admin
on Fri Dec 15 18:38:13 UTC 2023
Record UNII
E2I36FH6QZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHOXYBENZOIC ACID
FHFI  
Systematic Name English
NSC-9264
Code English
FEMA NO. 3944
Code English
BENZOIC ACID, 3-METHOXY-
Common Name English
M-ANISIC ACID
Systematic Name English
3-ANISIC ACID
Systematic Name English
3-METHOXYBENZOIC ACID [FHFI]
Common Name English
M-METHOXYBENZOIC ACID
Systematic Name English
NSC-27014
Code English
Classification Tree Code System Code
JECFA EVALUATION 3-METHOXYBENZOIC ACID
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID2060410
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY
FDA UNII
E2I36FH6QZ
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY
MESH
C056267
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY
ECHA (EC/EINECS)
209-574-9
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY
CAS
586-38-9
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY
NSC
9264
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY
CHEBI
88458
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY
JECFA MONOGRAPH
887
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY
PUBCHEM
11461
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY
NSC
27014
Created by admin on Fri Dec 15 18:38:13 UTC 2023 , Edited by admin on Fri Dec 15 18:38:13 UTC 2023
PRIMARY