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Ethyl 3-(3-chlorophenyl)-2-diethoxyphosphorylprop-2-enoate

HCID 178766076
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Basic information

CAS
107846-69-5
Standard SMILES
CCOC(=O)C(=Cc1cccc(Cl)c1)P(=O)(OCC)OCC
InChIKey
WLQDPYQBICHVBH-UHFFFAOYSA-N
Molecular formula
C15H20ClO5P
Average molar mass
346.74 g/mol

Names & identifiers

Preferred name
Ethyl 3-(3-chlorophenyl)-2-diethoxyphosphorylprop-2-enoate
IUPAC
ethyl 3-(3-chlorophenyl)-2-diethoxyphosphorylprop-2-enoate
English name
3-(3-Chlorophenyl)propenoic acid, 2-(diethoxyphosphinyl)- ethyl ester
Molecular formula
C15H20ClO5P
Molecular weight
346.74

Names & synonyms

3-(3-Chlorophenyl)propenoic acid, 2-(diethoxyphosphinyl)- ethyl ester2-Propenoic acid, 3-(3-chlorophenyl)-2-(diethoxyphosphinyl)-, ethyl ester

Database identifiers

CAS
107846-69-5

Properties

Computed structural propertiesFilling in

XLogP
3.2
Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
22
Formal charge
0
Complexity
428

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