Ethyl (Z)-3-diethoxyphosphoryloxy-3-phenyl-prop-2-enoate

HCID 225005

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Basic information

CAS: 27238-13-7
Standard SMILES: CCOC(=O)C=C(OP(=O)(OCC)OCC)c1ccccc1
InChIKey: ZSQCNQOWYXWZNY-UHFFFAOYSA-N
Molecular formula: C15H21O6P
Average molar mass: 328.3 g/mol
Monoisotopic mass: 328.10757538

Names & identifiers

Preferred name: Ethyl (Z)-3-diethoxyphosphoryloxy-3-phenyl-prop-2-enoate
IUPAC: ethyl 3-diethoxyphosphoryloxy-3-phenylprop-2-enoate

Names & synonyms

ETHYL (Z)-3-DIETHOXYPHOSPHORYLOXY-3-PHENYL-PROP-2-ENOATE27238-13-7SCHEMBL4748262ethyl 3-[(diethoxyphosphoryl)oxy]-3-phenylprop-2-enoateDTXSID80279752DS-007657

Database identifiers

CAS: 27238-13-7
PubChem CID: 225005
DTXSID: DTXSID80279752

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 71.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 10
Heavy atoms: 22
Formal charge: 0
Complexity: 404

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