oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium

C2HF5O2P+ — CID 123471378

IUPACoxo(1,1,2,2,2-pentafluoroethoxy)phosphanium
SMILESO=[PH+]OC(F)(F)C(F)(F)F
InChIInChI=1S/C2HF5O2P/c3-1(4,5)2(6,7)9-10-8/h10H/q+1
InChIKeyOADSZCSARMTEMS-UHFFFAOYSA-N
MW182.99 g/mol
LogP2.10
Rot. Bonds2

About oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium

oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium (PubChem CID 123471378) has the molecular formula C2HF5O2P+ and a molecular weight of 182.99 g/mol. Its IUPAC name is oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium.

Molecular Properties

Compound Nameoxo(1,1,2,2,2-pentafluoroethoxy)phosphanium
PubChem CID123471378
Molecular FormulaC2HF5O2P+
Molecular Weight182.99 g/mol
Exact Mass182.96
IUPAC Nameoxo(1,1,2,2,2-pentafluoroethoxy)phosphanium
SMILESO=[PH+]OC(F)(F)C(F)(F)F
InChIInChI=1S/C2HF5O2P/c3-1(4,5)2(6,7)9-10-8/h10H/q+1
InChIKeyOADSZCSARMTEMS-UHFFFAOYSA-N
XLogP2.10
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.99
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium?
The IUPAC name of oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium (CID 123471378) is oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium.
What is the SMILES notation for oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium?
The canonical SMILES for oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium is O=[PH+]OC(F)(F)C(F)(F)F.
What is the InChIKey of oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium?
The InChIKey is OADSZCSARMTEMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C2HF5O2P/c3-1(4,5)2(6,7)9-10-8/h10H/q+1.
What are the key properties of oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium?
oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium has a molecular weight of 182.99 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxo(1,1,2,2,2-pentafluoroethoxy)phosphanium is sourced from PubChem (CID 123471378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).