fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane

C6H2F13O2P — CID 23236351

IUPACfluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane
SMILESFP(OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H2F13O2P/c7-3(8,9)1(4(10,11)12)20-22(19)21-2(5(13,14)15)6(16,17)18/h1-2H
InChIKeyVWZVVEXVKRIMFY-UHFFFAOYSA-N
MW384.03 g/mol
LogP5.20
Rot. Bonds4

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

fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane (PubChem CID 23236351) has the molecular formula C6H2F13O2P and a molecular weight of 384.03 g/mol. Its IUPAC name is fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane.

Molecular Properties

Compound Namefluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane
PubChem CID23236351
Molecular FormulaC6H2F13O2P
Molecular Weight384.03 g/mol
Exact Mass383.96
IUPAC Namefluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane
SMILESFP(OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H2F13O2P/c7-3(8,9)1(4(10,11)12)20-22(19)21-2(5(13,14)15)6(16,17)18/h1-2H
InChIKeyVWZVVEXVKRIMFY-UHFFFAOYSA-N
XLogP5.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.03
LogP ≤ 55.20
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 fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane?
The IUPAC name of fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane (CID 23236351) is fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane.
What is the SMILES notation for fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane?
The canonical SMILES for fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane is FP(OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F.
What is the InChIKey of fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane?
The InChIKey is VWZVVEXVKRIMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2F13O2P/c7-3(8,9)1(4(10,11)12)20-22(19)21-2(5(13,14)15)6(16,17)18/h1-2H.
What are the key properties of fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane?
fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane has a molecular weight of 384.03 g/mol, XLogP of 5.20, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)phosphane is sourced from PubChem (CID 23236351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).