copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane

C6H10CuF4O3P — CID 139264099

IUPACcopper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane
SMILESCCOP(=O)(OCC)C(F)(F)[C-](F)F.[Cu+]
InChIInChI=1S/C6H10F4O3P.Cu/c1-3-12-14(11,13-4-2)6(9,10)5(7)8;/h3-4H2,1-2H3;/q-1;+1
InChIKeyFTQGOSPXRIZLEW-UHFFFAOYSA-N
MW300.66 g/mol
LogP3.27
Rot. Bonds6

About copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane

copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane (PubChem CID 139264099) has the molecular formula C6H10CuF4O3P and a molecular weight of 300.66 g/mol. Its IUPAC name is copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane.

Molecular Properties

Compound Namecopper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane
PubChem CID139264099
Molecular FormulaC6H10CuF4O3P
Molecular Weight300.66 g/mol
Exact Mass299.96
IUPAC Namecopper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane
SMILESCCOP(=O)(OCC)C(F)(F)[C-](F)F.[Cu+]
InChIInChI=1S/C6H10F4O3P.Cu/c1-3-12-14(11,13-4-2)6(9,10)5(7)8;/h3-4H2,1-2H3;/q-1;+1
InChIKeyFTQGOSPXRIZLEW-UHFFFAOYSA-N
XLogP3.27
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.66
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane?
The IUPAC name of copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane (CID 139264099) is copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane.
What is the SMILES notation for copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane?
The canonical SMILES for copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane is CCOP(=O)(OCC)C(F)(F)[C-](F)F.[Cu+].
What is the InChIKey of copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane?
The InChIKey is FTQGOSPXRIZLEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F4O3P.Cu/c1-3-12-14(11,13-4-2)6(9,10)5(7)8;/h3-4H2,1-2H3;/q-1;+1.
What are the key properties of copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane?
copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane has a molecular weight of 300.66 g/mol, XLogP of 3.27, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for copper(1+);1-diethoxyphosphoryl-1,1,2,2-tetrafluoroethane is sourced from PubChem (CID 139264099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).