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CAS Number: 51069-90-0
6-bromo-4-chloro-2-oxo-2H-chromene-3-carbaldehyde

Structure

 6-bromo-4-chloro-2-oxo-2H-chromene-3-carbaldehyde
Name: 6-bromo-4-chloro-2-oxo-2H-chromene-3-carbaldehyde
Synonyms:
General Information
Product Number: 51069900

CAS Registry Number 51069-90-0
Name:
2H-?1-?Benzopyran-?3-?carboxaldehyde, 6-?bromo-?4-?chloro-?2-?oxo-
6-Bromo-4-chloro-2-oxo-2H-1-benzopyran-3-carboxaldehyde
6-Bromo-4-chloro-3-formylcoumarin

 

Chemical Formula: C10H4BrClO3
Exact Mass: 285.90
Molecular Weight: 287.49
m/z: 287.90 (100.0%), 285.90 (77.4%), 289.90 (24.2%), 288.90 (10.8%), 286.91 (8.5%), 290.90 (2.6%), 289.91 (1.0%)

 

InChI:InChI=1S/C10H4BrClO3/c11-5-1-2-8-6(3-5)9(12)7(4-13)10(14)15-8/h1-4H

InChI Key:IODFACUSJKQFGW-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1Br)C(=C(C(=O)O2)C=O)Cl

Specification

98%
References

PCT Int. Appl. (2008), WO 2008091946 A2 20080731.                                  

Bioorganic & Medicinal Chemistry (2014), 22(15), 4119-4123. 
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