2-[(Z)-2-diethoxyphosphorylethenyl]furan

C10H15O4P — CID 122219696

IUPAC2-[(Z)-2-diethoxyphosphorylethenyl]furan
SMILESCCOP(=O)(/C=C\c1ccco1)OCC
InChIInChI=1S/C10H15O4P/c1-3-13-15(11,14-4-2)9-7-10-6-5-8-12-10/h5-9H,3-4H2,1-2H3/b9-7-
InChIKeyMIWDBNGXLUHHFZ-CLFYSBASSA-N
MW230.20 g/mol
LogP3.52
Rot. Bonds6

About 2-[(Z)-2-diethoxyphosphorylethenyl]furan

2-[(Z)-2-diethoxyphosphorylethenyl]furan (PubChem CID 122219696) has the molecular formula C10H15O4P and a molecular weight of 230.20 g/mol. Its IUPAC name is 2-[(Z)-2-diethoxyphosphorylethenyl]furan.

Molecular Properties

Compound Name2-[(Z)-2-diethoxyphosphorylethenyl]furan
PubChem CID122219696
Molecular FormulaC10H15O4P
Molecular Weight230.20 g/mol
Exact Mass230.07
IUPAC Name2-[(Z)-2-diethoxyphosphorylethenyl]furan
SMILESCCOP(=O)(/C=C\c1ccco1)OCC
InChIInChI=1S/C10H15O4P/c1-3-13-15(11,14-4-2)9-7-10-6-5-8-12-10/h5-9H,3-4H2,1-2H3/b9-7-
InChIKeyMIWDBNGXLUHHFZ-CLFYSBASSA-N
XLogP3.52
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.20
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2-diethoxyphosphorylethenyl]furan?
The IUPAC name of 2-[(Z)-2-diethoxyphosphorylethenyl]furan (CID 122219696) is 2-[(Z)-2-diethoxyphosphorylethenyl]furan.
What is the SMILES notation for 2-[(Z)-2-diethoxyphosphorylethenyl]furan?
The canonical SMILES for 2-[(Z)-2-diethoxyphosphorylethenyl]furan is CCOP(=O)(/C=C\c1ccco1)OCC.
What is the InChIKey of 2-[(Z)-2-diethoxyphosphorylethenyl]furan?
The InChIKey is MIWDBNGXLUHHFZ-CLFYSBASSA-N. The full InChI is InChI=1S/C10H15O4P/c1-3-13-15(11,14-4-2)9-7-10-6-5-8-12-10/h5-9H,3-4H2,1-2H3/b9-7-.
What are the key properties of 2-[(Z)-2-diethoxyphosphorylethenyl]furan?
2-[(Z)-2-diethoxyphosphorylethenyl]furan has a molecular weight of 230.20 g/mol, XLogP of 3.52, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-diethoxyphosphorylethenyl]furan is sourced from PubChem (CID 122219696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).