trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane

C6H2F15O2P — CID 23236360

IUPACtrifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane
SMILESFC(F)(F)C(OP(F)(F)(F)OC(C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H2F15O2P/c7-3(8,9)1(4(10,11)12)22-24(19,20,21)23-2(5(13,14)15)6(16,17)18/h1-2H
InChIKeyFAPWMOLEZYYGQB-UHFFFAOYSA-N
MW422.02 g/mol
LogP6.04
Rot. Bonds4

About trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane

trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane (PubChem CID 23236360) has the molecular formula C6H2F15O2P and a molecular weight of 422.02 g/mol. Its IUPAC name is trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane.

Molecular Properties

Compound Nametrifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane
PubChem CID23236360
Molecular FormulaC6H2F15O2P
Molecular Weight422.02 g/mol
Exact Mass421.96
IUPAC Nametrifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane
SMILESFC(F)(F)C(OP(F)(F)(F)OC(C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H2F15O2P/c7-3(8,9)1(4(10,11)12)22-24(19,20,21)23-2(5(13,14)15)6(16,17)18/h1-2H
InChIKeyFAPWMOLEZYYGQB-UHFFFAOYSA-N
XLogP6.04
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.02
LogP ≤ 56.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane?
The IUPAC name of trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane (CID 23236360) is trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane.
What is the SMILES notation for trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane?
The canonical SMILES for trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane is FC(F)(F)C(OP(F)(F)(F)OC(C(F)(F)F)C(F)(F)F)C(F)(F)F.
What is the InChIKey of trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane?
The InChIKey is FAPWMOLEZYYGQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2F15O2P/c7-3(8,9)1(4(10,11)12)22-24(19,20,21)23-2(5(13,14)15)6(16,17)18/h1-2H.
What are the key properties of trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane?
trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane has a molecular weight of 422.02 g/mol, XLogP of 6.04, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-λ5-phosphane is sourced from PubChem (CID 23236360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).