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Details

Stereochemistry RACEMIC
Molecular Formula C2H2BrClO2
Molecular Weight 173.393
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BROMOCHLOROACETIC ACID

SMILES

OC(=O)C(Cl)Br

InChI

InChIKey=GEHJBWKLJVFKPS-UHFFFAOYSA-N
InChI=1S/C2H2BrClO2/c3-1(4)2(5)6/h1H,(H,5,6)

HIDE SMILES / InChI

Molecular Formula C2H2BrClO2
Molecular Weight 173.393
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Stereospecific toxicokinetics of bromochloro- and chlorofluoroacetate: effect of GST-zeta depletion.
2001 Sep 1
Kinetics of haloacetic acid reactions with Fe(0).
2004 Dec 15
[Investigation of bromate, haloacetic acids and perchlorate in Beijing's drinking water].
2004 Mar
Developmental toxicity of mixtures: the water disinfection by-products dichloro-, dibromo- and bromochloro acetic acid in rat embryo culture.
2004 Nov
Development of normal human colon cell cultures to identify priority unregulated disinfection by-products with a carcinogenic potential.
2007
Development of a less toxic dichloroacetate analogue by docking and descriptor analysis.
2010 Jul 6
Mouse embryonic stem cell adherent cell differentiation and cytotoxicity (ACDC) assay.
2011 May
The synergistic effect of sodium chlorite and bromochloroacetic acid on BrO3(-)-induced renal cell death.
2011 Nov 18
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:50:16 GMT 2023
Edited
by admin
on Sat Dec 16 08:50:16 GMT 2023
Record UNII
AL8MZ37Y51
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BROMOCHLOROACETIC ACID
Systematic Name English
ACETIC ACID, BROMOCHLORO-
Systematic Name English
ACETIC ACID, 2-BROMO-2-CHLORO-
Systematic Name English
CHLOROBROMOACETIC ACID [HSDB]
Common Name English
BROMOCHLOROACETIC ACID [IARC]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID4024642
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
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HSDB
7619
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
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FDA UNII
AL8MZ37Y51
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
PRIMARY
CAS
5589-96-8
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
PRIMARY
PUBCHEM
542762
Created by admin on Sat Dec 16 08:50:16 GMT 2023 , Edited by admin on Sat Dec 16 08:50:16 GMT 2023
PRIMARY