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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7BrO
Molecular Weight 199.045
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Bromobenzeneacetaldehyde

SMILES

BrC1=CC(CC=O)=CC=C1

InChI

InChIKey=GQPCWVVXGHFKQY-UHFFFAOYSA-N
InChI=1S/C8H7BrO/c9-8-3-1-2-7(6-8)4-5-10/h1-3,5-6H,4H2

HIDE SMILES / InChI

Molecular Formula C8H7BrO
Molecular Weight 199.045
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 Wed Apr 02 18:03:47 GMT 2025
Edited
by admin
on Wed Apr 02 18:03:47 GMT 2025
Record UNII
4ATG96ULL2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Bromobenzeneacetaldehyde
Systematic Name English
(3-Bromophenyl)acetaldehyde
Preferred Name English
Benzeneacetaldehyde, 3-bromo-
Systematic Name English
2-(3-Bromophenyl)acetaldehyde
Systematic Name English
Code System Code Type Description
PUBCHEM
20387554
Created by admin on Wed Apr 02 18:03:47 GMT 2025 , Edited by admin on Wed Apr 02 18:03:47 GMT 2025
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CAS
109347-40-2
Created by admin on Wed Apr 02 18:03:47 GMT 2025 , Edited by admin on Wed Apr 02 18:03:47 GMT 2025
PRIMARY
FDA UNII
4ATG96ULL2
Created by admin on Wed Apr 02 18:03:47 GMT 2025 , Edited by admin on Wed Apr 02 18:03:47 GMT 2025
PRIMARY
EPA CompTox
DTXSID30606559
Created by admin on Wed Apr 02 18:03:47 GMT 2025 , Edited by admin on Wed Apr 02 18:03:47 GMT 2025
PRIMARY