ethyl 8-bromo-6-methoxy-4-oxo-4H-chromene-2-carboxylate

HCID 22142256
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Basic information

Standard SMILES
CCOC(=O)c1cc(=O)c2cc(OC)cc(Br)c2o1
InChIKey
RCVPYVWCNLJBMO-UHFFFAOYSA-N
Molecular formula
C13H11BrO5
Average molar mass
327.13 g/mol
Monoisotopic mass
325.97899

Names & identifiers

Preferred name
ethyl 8-bromo-6-methoxy-4-oxo-4H-chromene-2-carboxylate
IUPAC
ethyl 8-bromo-6-methoxy-4-oxochromene-2-carboxylate

Names & synonyms

ethyl 8-bromo-6-methoxy-4-oxo-4H-chromene-2-carboxylate442549-35-1SCHEMBL4253257RCVPYVWCNLJBMO-UHFFFAOYSA-NDB-3195268-bromo-6-methoxy-4-oxo-4H-chromene-2-carboxylic acid ethyl ester

Database identifiers

PubChem CID
22142256

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
19

Related reactions

10 records
New reaction record

Compound notes

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