3-Bromophenylacetic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H7BrO2
Molecular Weight	215.044
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Bromophenylacetic acid

Structure Search

SMILES

OC(=O)CC1=CC=CC(Br)=C1

InChI

InChIKey=KYNNBXCGXUOREX-UHFFFAOYSA-N

InChI=1S/C8H7BrO2/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4H,5H2,(H,10,11)

HIDE SMILES / InChI

Molecular Formula	C8H7BrO2
Molecular Weight	215.044
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 `Sat Dec 16 20:06:34 GMT 2023` Edited by `admin` on `Sat Dec 16 20:06:34 GMT 2023`
Record UNII	6QF7XW7X4J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Bromophenylacetic acid

Systematic Name

English

Code System Code Type Description

PUBCHEM

74653

Created by admin on Sat Dec 16 20:06:34 GMT 2023 , Edited by admin on Sat Dec 16 20:06:34 GMT 2023

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EPA CompTox

DTXSID0075152

Created by admin on Sat Dec 16 20:06:34 GMT 2023 , Edited by admin on Sat Dec 16 20:06:34 GMT 2023

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ECHA (EC/EINECS)

217-522-1

Created by admin on Sat Dec 16 20:06:34 GMT 2023 , Edited by admin on Sat Dec 16 20:06:34 GMT 2023

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FDA UNII

6QF7XW7X4J

Created by admin on Sat Dec 16 20:06:34 GMT 2023 , Edited by admin on Sat Dec 16 20:06:34 GMT 2023

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CAS

1878-67-7

Created by admin on Sat Dec 16 20:06:34 GMT 2023 , Edited by admin on Sat Dec 16 20:06:34 GMT 2023

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