(3R)-6-bromo-3-methyl-3,4-dihydro-1H-isochromen-1-one

HCID 71270763
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Basic information

Standard SMILES
C[C@@H]1Cc2cc(Br)ccc2C(=O)O1
InChIKey
FQXNEJZEPHQHEK-ZCFIWIBFSA-N
Molecular formula
C10H9BrO2
Average molar mass
241.08 g/mol

Names & identifiers

Preferred name
(3R)-6-bromo-3-methyl-3,4-dihydro-1H-isochromen-1-one
IUPAC
(3R)-6-bromo-3-methyl-3,4-dihydroisochromen-1-one

Names & synonyms

SCHEMBL14720177SCHEMBL31098420FQXNEJZEPHQHEK-ZCFIWIBFSA-N(3R)-6-bromo-3-methyl-3,4-dihydro-1H-isochromen-1 -one(3R)-6-bromo-3-methyl-3,4-dihydro-1H-isochromen-1-one

Database identifiers

PubChem CID
71270763

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
13

Related reactions

13 records
New reaction record

Linked notes

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