(Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene

C7H11F4O3P — CID 13196903

IUPAC(Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene
SMILESCCOP(=O)(/C=C(\F)C(F)(F)F)OCC
InChIInChI=1S/C7H11F4O3P/c1-3-13-15(12,14-4-2)5-6(8)7(9,10)11/h5H,3-4H2,1-2H3/b6-5-
InChIKeyKPZIBGWKSDRFAO-WAYWQWQTSA-N
MW250.13 g/mol
LogP3.63
Rot. Bonds5

About (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene

(Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene (PubChem CID 13196903) has the molecular formula C7H11F4O3P and a molecular weight of 250.13 g/mol. Its IUPAC name is (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene.

Molecular Properties

Compound Name(Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene
PubChem CID13196903
Molecular FormulaC7H11F4O3P
Molecular Weight250.13 g/mol
Exact Mass250.04
IUPAC Name(Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene
SMILESCCOP(=O)(/C=C(\F)C(F)(F)F)OCC
InChIInChI=1S/C7H11F4O3P/c1-3-13-15(12,14-4-2)5-6(8)7(9,10)11/h5H,3-4H2,1-2H3/b6-5-
InChIKeyKPZIBGWKSDRFAO-WAYWQWQTSA-N
XLogP3.63
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.13
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene?
The IUPAC name of (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene (CID 13196903) is (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene.
What is the SMILES notation for (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene?
The canonical SMILES for (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene is CCOP(=O)(/C=C(\F)C(F)(F)F)OCC.
What is the InChIKey of (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene?
The InChIKey is KPZIBGWKSDRFAO-WAYWQWQTSA-N. The full InChI is InChI=1S/C7H11F4O3P/c1-3-13-15(12,14-4-2)5-6(8)7(9,10)11/h5H,3-4H2,1-2H3/b6-5-.
What are the key properties of (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene?
(Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene has a molecular weight of 250.13 g/mol, XLogP of 3.63, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-diethoxyphosphoryl-2,3,3,3-tetrafluoroprop-1-ene is sourced from PubChem (CID 13196903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).