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Details

Stereochemistry ACHIRAL
Molecular Formula C9H9BrO2
Molecular Weight 229.071
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 2-bromobenzoate

SMILES

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

InChI

InChIKey=BIHHBTVQFPVSTE-UHFFFAOYSA-N
InChI=1S/C9H9BrO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H9BrO2
Molecular Weight 229.071
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 19:16:20 GMT 2025
Edited
by admin
on Tue Apr 01 19:16:20 GMT 2025
Record UNII
L9R5D34BM7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethyl 2-bromobenzoate
Systematic Name English
NSC-10122
Preferred Name English
Benzoic acid, 2-bromo-, ethyl ester
Systematic Name English
Ethyl o-bromobenzoate
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
228-034-3
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
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EPA CompTox
DTXSID80209751
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
PRIMARY
CAS
6091-64-1
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
PRIMARY
NSC
10122
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
PRIMARY
PUBCHEM
80186
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
PRIMARY
FDA UNII
L9R5D34BM7
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
PRIMARY