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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H11BrO2
Molecular Weight 195.054
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL .ALPHA.-BROMOBUTYRATE, (+)-

SMILES

CCOC(=O)[C@H](Br)CC

InChI

InChIKey=XIMFCGSNSKXPBO-RXMQYKEDSA-N
InChI=1S/C6H11BrO2/c1-3-5(7)6(8)9-4-2/h5H,3-4H2,1-2H3/t5-/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
BUTANOIC ACID, 2-BROMO-, ETHYL ESTER, (+)-
Preferred Name English
ETHYL .ALPHA.-BROMOBUTYRATE, (+)-
Systematic Name English
BUTANOIC ACID, 2-BROMO-, ETHYL ESTER, (2R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
7000062
Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025
PRIMARY
FDA UNII
U8G0KUB48J
Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025
PRIMARY
CAS
130251-07-9
Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025
PRIMARY
NIH
NCATS
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