(3-(4-Bromophenyl)-2-oxiranyl)phenylmethanone

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Basic information

CAS: 40327-54-6
Standard SMILES: O=C(c1ccccc1)C1OC1c1ccc(Br)cc1
InChIKey: UBCKDZOHNXGSOZ-UHFFFAOYSA-N
Molecular formula: C15H11BrO2
Average molar mass: 303.15 g/mol
Monoisotopic mass: 301.99424

Names & identifiers

Preferred name: (3-(4-Bromophenyl)-2-oxiranyl)phenylmethanone
IUPAC: [3-(4-bromophenyl)oxiran-2-yl]-phenylmethanone

Names & synonyms

[3-(4-Bromophenyl)-2-oxiranyl]phenylmethanone40327-54-6(3-(4-Bromophenyl)-2-oxiranyl)phenylmethanoneRefChem:207455SCHEMBL29110664DTXSID801255135[3-(4-bromophenyl)oxiran-2-yl](phenyl)methanone

Database identifiers

CAS: 40327-54-6
PubChem CID: 12920752
DTXSID: DTXSID801255135
Nikkaji: J565.596J

Properties

Computed structural properties

XLogP: 3.5
Topological polar surface area: 29.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 18
Formal charge: 0
Complexity: 304

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Compound notes

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