3-(Benzyloxy)-6-oxa-3lambda~5~-phosphabicyclo[3.1.0]hexan-3-one

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Basic information

CAS: 170938-32-6
Standard SMILES: O=P1(OCc2ccccc2)CC2OC2C1
InChIKey: HQYOZYSHMQCCNG-UHFFFAOYSA-N
Molecular formula: C11H13O3P
Average molar mass: 224.19 g/mol
Monoisotopic mass: 224.06023127

Names & identifiers

Preferred name: 3-(Benzyloxy)-6-oxa-3lambda~5~-phosphabicyclo[3.1.0]hexan-3-one
IUPAC: 3-phenylmethoxy-6-oxa-3λ5-phosphabicyclo[3.1.0]hexane 3-oxide

Names & synonyms

SCHEMBL6434250DTXSID0011701893-(Benzyloxy)-6-oxa-3lambda~5~-phosphabicyclo[3.1.0]hexan-3-one6-Oxa-3-phosphabicyclo[3.1.0]hexane, 3-(phenylmethoxy)-, 3-oxide170938-32-6

Database identifiers

CAS: 170938-32-6
PubChem CID: 60000740
DTXSID: DTXSID001170189

Properties

Computed structural properties

XLogP: 0.5
Topological polar surface area: 38.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 272

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