Ethyl 2-(diethoxyphosphoryl)-3-(4-nitrophenyl)prop-2-enoate

HCID 367443

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Basic information

CAS: 76386-70-4
Standard SMILES: CCOC(=O)C(=Cc1ccc([N+](=O)[O-])cc1)P(=O)(OCC)OCC
InChIKey: XPCUBCCQTGICBN-UHFFFAOYSA-N
Molecular formula: C15H20NO7P
Average molar mass: 357.29 g/mol
Monoisotopic mass: 357.09773897

Names & identifiers

Preferred name: Ethyl 2-(diethoxyphosphoryl)-3-(4-nitrophenyl)prop-2-enoate
IUPAC: ethyl 2-diethoxyphosphoryl-3-(4-nitrophenyl)prop-2-enoate
English name: Ethyl (2Z)-2-(diethoxyphosphoryl)-3-(4-nitrophenyl)-2-propenoate
Molecular weight: 0

Names & synonyms

ethyl 2-(diethoxyphosphoryl)-3-(4-nitrophenyl)prop-2-enoate76386-70-4SCHEMBL5771601DTXSID40327208Ethyl (2Z)-2-(diethoxyphosphoryl)-3-(4-nitrophenyl)-2-propenoate

Database identifiers

CAS: 76386-70-4
PubChem CID: 367443
DTXSID: DTXSID40327208

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 108 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 7
Rotatable bonds: 9
Heavy atoms: 24
Formal charge: 0
Complexity: 496

Chemistry & industry

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

Related reactions

1 records

New reaction record

HRID 1555858As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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