4-chloro-8-(cyclopentyloxy)-7-methoxy-2H-chromen-2-one

HCID 77174794
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Basic information

Standard SMILES
COc1ccc2c(Cl)cc(=O)oc2c1OC1CCCC1
InChIKey
NRXVFWNGJTYGGS-UHFFFAOYSA-N
Molecular formula
C15H15ClO4
Average molar mass
294.73 g/mol
Monoisotopic mass
294.0658866

Names & identifiers

Preferred name
4-chloro-8-(cyclopentyloxy)-7-methoxy-2H-chromen-2-one
IUPAC
4-chloro-8-cyclopentyloxy-7-methoxychromen-2-one

Names & synonyms

1001056-82-1SCHEMBL3675535NRXVFWNGJTYGGS-UHFFFAOYSA-NDB-0582924-chloro-8-(cyclopentyloxy)-7-methoxy-2H-chromen-2-one

Database identifiers

PubChem CID
77174794

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
20

Related reactions

17 records
New reaction record

Linked notes

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