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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5BrO2
Molecular Weight 201.017
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-BROMOBENZOIC ACID

SMILES

OC(=O)C1=CC=C(Br)C=C1

InChI

InChIKey=TUXYZHVUPGXXQG-UHFFFAOYSA-N
InChI=1S/C7H5BrO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)

HIDE SMILES / InChI

Molecular Formula C7H5BrO2
Molecular Weight 201.017
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Preparative chiral liquid chromatography for enantiomeric separation of pheromones.
2001 Mar
Isolation and structure elucidation of Sch 642305, a novel bacterial DNA primase inhibitor produced by Penicillium verrucosum.
2003 Dec
Glochidionionosides A-D: megastigmane glucosides from leaves of Glochidion zeylanicum (Gaertn.) A. Juss.
2003 Mar
Isolation and characterization of a lipoxygenase from Pseudomonas 42A2 responsible for the biotransformation of oleic acid into ( S )-( E )-10-hydroxy-8-octadecenoic acid.
2004 Feb
Inhibitory effects of 4-halobenzoic acids on the diphenolase and monophenolase activity of mushroom tyrosinase.
2004 Jul
Identification of genes coding for hydrolytic dehalogenation in the metagenome derived from a denitrifying 4-chlorobenzoate degrading consortium.
2008 Apr
(R)-1-(4-Bromo-benzo-yl)-4-(1-phenyl-prop-yl)thio-semicarbazide.
2008 Apr 10
Diaquabis(4-bromo-benzoato-κO)-bis(N,N'-diethyl-nicotinamide-κN)zinc(II).
2008 Aug 30
Method to determine enantiomeric excess of glucose by nonchiral high-performance liquid chromatography using circular dichroism detection.
2008 Feb 1
Diaqua-bis(4-bromo-benzoato-κO,O')zinc(II).
2008 Feb 6
Layered double hydroxide intercalated with p-methylbenzoate and p-bromobenzoate: molecular simulations and XRD analysis.
2008 Mar 1
Toxicity and quantitative structure-activity relationships of benzoic acids to Pseudokirchneriella subcapitata.
2009 Jun 15
Packing behaviour of two predominant anionic phospholipids of bacterial cytoplasmic membranes.
2010 Aug
Preparation and utility of trihaloethyl imidates: useful reagents for the synthesis of amidines.
2010 Feb 5
Bis(4-bromo-benzo-yl)(2,7-dimethoxy-naphthalene-1,8-di-yl)dimethanone.
2010 Jan 20
Tris(1,10-phenanthroline-κN,N')zinc(II) bis-(4-bromo-benzoate) 6.5-hydrate.
2010 Mar 31
(4-Bromo-phen-yl)(3,6-dimeth-oxy-2-naphth-yl)methanone.
2010 Oct 13
Aqua-(4-bromo-benzoato-κO)bis-(1,10-phenanthroline-κN,N')zinc(II) 4-bromo-benzoate 1.5-hydrate.
2010 Oct 2
Tetra-aqua(2,2'-bipyridine-κN,N')magnesium(II) bis-(4-bromo-benzoate).
2010 Oct 23
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 04:19:08 GMT 2023
Edited
by admin
on Sat Dec 16 04:19:08 GMT 2023
Record UNII
6992P6102O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-BROMOBENZOIC ACID
MI  
Systematic Name English
NSC-143357
Code English
BROMOBENZOIC ACID, P-
Common Name English
NSC-17582
Code English
4-BROMOBENZOIC ACID [MI]
Common Name English
P-BROMOBENZOIC ACID
Common Name English
P-BROMOBENZENECARBOXYLIC ACID
Common Name English
4-BROMOBENZENECARBOXYLIC ACID
Systematic Name English
P-CARBOXYBROMOBENZENE
Common Name English
NSC-176126
Code English
Code System Code Type Description
MERCK INDEX
m2685
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
209-581-7
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY
NSC
17582
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY
CHEBI
60698
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID7060413
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY
NSC
176126
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY
CAS
586-76-5
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY
FDA UNII
6992P6102O
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY
PUBCHEM
11464
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY
NSC
143357
Created by admin on Sat Dec 16 04:19:08 GMT 2023 , Edited by admin on Sat Dec 16 04:19:08 GMT 2023
PRIMARY