4-Bromophthalic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H5BrO4
Molecular Weight	245.027
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-Bromophthalic acid

Structure Search

SMILES

OC(=O)C1=CC=C(Br)C=C1C(O)=O

InChI

InChIKey=AZXKGUVDIORSED-UHFFFAOYSA-N

InChI=1S/C8H5BrO4/c9-4-1-2-5(7(10)11)6(3-4)8(12)13/h1-3H,(H,10,11)(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C8H5BrO4
Molecular Weight	245.027
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:48:35 GMT 2025` Edited by `admin` on `Tue Apr 01 16:48:35 GMT 2025`
Record UNII	DX3373TJ24
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-Bromophthalic acid

Systematic Name

English

NSC-20682

Preferred Name

English

1,2-Benzenedicarboxylic acid, 4-bromo-

Systematic Name

English

4-Bromo-1,2-benzenedicarboxylic acid

Systematic Name

English

Code System Code Type Description

NSC

20682

Created by admin on Tue Apr 01 16:48:35 GMT 2025 , Edited by admin on Tue Apr 01 16:48:35 GMT 2025

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CAS

6968-28-1

Created by admin on Tue Apr 01 16:48:35 GMT 2025 , Edited by admin on Tue Apr 01 16:48:35 GMT 2025

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EPA CompTox

DTXSID00219973

Created by admin on Tue Apr 01 16:48:35 GMT 2025 , Edited by admin on Tue Apr 01 16:48:35 GMT 2025

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ECHA (EC/EINECS)

230-183-4

Created by admin on Tue Apr 01 16:48:35 GMT 2025 , Edited by admin on Tue Apr 01 16:48:35 GMT 2025

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FDA UNII

DX3373TJ24

Created by admin on Tue Apr 01 16:48:35 GMT 2025 , Edited by admin on Tue Apr 01 16:48:35 GMT 2025

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PUBCHEM

81428

Created by admin on Tue Apr 01 16:48:35 GMT 2025 , Edited by admin on Tue Apr 01 16:48:35 GMT 2025

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