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Phosphonic acid, (2-(2-pyridyl)vinyl)-, dibutyl ester

HCID 5789181
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Basic information

CAS
23614-28-0
Standard SMILES
CCCCOP(=O)(/C=C/c1ccccn1)OCCCC
InChIKey
JVWJNXLTZSBRJA-UHFFFAOYSA-N
Molecular formula
C15H24NO3P
Average molar mass
297.33 g/mol
Monoisotopic mass
297.14938063

Names & identifiers

Preferred name
Phosphonic acid, (2-(2-pyridyl)vinyl)-, dibutyl ester
IUPAC
2-[(E)-2-dibutoxyphosphorylethenyl]pyridine
English name
[2-(2-Pyridyl)ethenyl]phosphonic acid dibutyl ester
Molecular formula
C15H24NO3P
Molecular weight
297.33

Names & synonyms

23614-28-0Phosphonic acid, (2-(2-pyridyl)vinyl)-, dibutyl esterRefChem:10951502-(2-Pyridyl)vinylphosphonic acid dibutyl esterBRN 0419518Dibutyl 2-(alpha-pyridyl)vinylphosphonateNSC194847[2-(2-Pyridyl)ethenyl]phosphonic acid dibutyl esterDibutyl 2-(2-pyridinyl)vinylphosphonate2-[(E)-2-dibutoxyphosphorylvinyl]pyridinePhosphonic acid, [2-(2-pyridyl)vinyl]-, dibutyl ester (8CI)

Database identifiers

CAS
23614-28-0
PubChem CID
5789181
Nikkaji
J50.311H

Properties

Computed structural propertiesFilling in

XLogP
2.9
Topological polar surface area
48.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
10
Heavy atoms
20
Formal charge
0
Complexity
306

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