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Details

Stereochemistry ACHIRAL
Molecular Formula C9H8BrNO4
Molecular Weight 274.068
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(4-Bromo-2-carboxyphenyl)glycine

SMILES

OC(=O)CNC1=CC=C(Br)C=C1C(O)=O

InChI

InChIKey=NGTZRRAYYJFRDA-UHFFFAOYSA-N
InChI=1S/C9H8BrNO4/c10-5-1-2-7(11-4-8(12)13)6(3-5)9(14)15/h1-3,11H,4H2,(H,12,13)(H,14,15)

HIDE SMILES / InChI

Molecular Formula C9H8BrNO4
Molecular Weight 274.068
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 18:44:20 GMT 2025
Edited
by admin
on Tue Apr 01 18:44:20 GMT 2025
Record UNII
AW7AQ6YW4H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-21416
Preferred Name English
N-(4-Bromo-2-carboxyphenyl)glycine
Systematic Name English
Benzoic acid, 5-bromo-2-[(carboxymethyl)amino]-
Systematic Name English
5-Bromo-2-[(carboxymethyl)amino]benzoic acid
Systematic Name English
Code System Code Type Description
CAS
32253-75-1
Created by admin on Tue Apr 01 18:44:20 GMT 2025 , Edited by admin on Tue Apr 01 18:44:20 GMT 2025
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NSC
21416
Created by admin on Tue Apr 01 18:44:20 GMT 2025 , Edited by admin on Tue Apr 01 18:44:20 GMT 2025
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ECHA (EC/EINECS)
250-973-2
Created by admin on Tue Apr 01 18:44:20 GMT 2025 , Edited by admin on Tue Apr 01 18:44:20 GMT 2025
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FDA UNII
AW7AQ6YW4H
Created by admin on Tue Apr 01 18:44:20 GMT 2025 , Edited by admin on Tue Apr 01 18:44:20 GMT 2025
PRIMARY
PUBCHEM
95158
Created by admin on Tue Apr 01 18:44:20 GMT 2025 , Edited by admin on Tue Apr 01 18:44:20 GMT 2025
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EPA CompTox
DTXSID70186007
Created by admin on Tue Apr 01 18:44:20 GMT 2025 , Edited by admin on Tue Apr 01 18:44:20 GMT 2025
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