bis(3-fluoropentan-3-yloxy)-oxophosphanium

C10H20F2O3P+ — CID 88634280

IUPACbis(3-fluoropentan-3-yloxy)-oxophosphanium
SMILESCCC(F)(CC)O[P+](=O)OC(F)(CC)CC
InChIInChI=1S/C10H20F2O3P/c1-5-9(11,6-2)14-16(13)15-10(12,7-3)8-4/h5-8H2,1-4H3/q+1
InChIKeyZYFLQHYMKCLMDV-UHFFFAOYSA-N
MW257.24 g/mol
LogP4.65
Rot. Bonds8

About bis(3-fluoropentan-3-yloxy)-oxophosphanium

bis(3-fluoropentan-3-yloxy)-oxophosphanium (PubChem CID 88634280) has the molecular formula C10H20F2O3P+ and a molecular weight of 257.24 g/mol. Its IUPAC name is bis(3-fluoropentan-3-yloxy)-oxophosphanium.

Molecular Properties

Compound Namebis(3-fluoropentan-3-yloxy)-oxophosphanium
PubChem CID88634280
Molecular FormulaC10H20F2O3P+
Molecular Weight257.24 g/mol
Exact Mass257.11
IUPAC Namebis(3-fluoropentan-3-yloxy)-oxophosphanium
SMILESCCC(F)(CC)O[P+](=O)OC(F)(CC)CC
InChIInChI=1S/C10H20F2O3P/c1-5-9(11,6-2)14-16(13)15-10(12,7-3)8-4/h5-8H2,1-4H3/q+1
InChIKeyZYFLQHYMKCLMDV-UHFFFAOYSA-N
XLogP4.65
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.24
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

oxo-bis(1,1,2-trichlorobutoxy)phosphanium
CID 22748458
bis[[1-(chloromethoxy)-3-ethylpentan-3-yl]oxy]-oxophosphanium
CID 88516698
ethoxy-oxo-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexoxy)phosphanium
CID 122507209
oxo-bis(5-propylnonan-5-yloxy)phosphanium
CID 87060248
bis(2-aminopropan-2-yloxy)-oxophosphanium
CID 87210634
sodium;ethoxy-oxo-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexoxy)phosphanium;hydride
CID 175432761
[bromo(difluoro)methyl]-ethoxy-oxophosphanium
CID 176768502
3-chloropentan-3-yloxy-hydroxy-oxophosphanium
CID 87677652
bis[3-(2-ethoxyethoxycarbonyl)pentan-3-yloxy]-oxophosphanium
CID 57099100
3-ethylpentan-3-ylphosphanide
CID 13330846
(1,1,1-trifluoro-2-methylbutan-2-yl) formate
CID 162773826
ethyl 3,4,4,4-tetrafluoro-3-(trifluoromethyl)butanoate
CID 170871932

Frequently Asked Questions

What is the IUPAC name of bis(3-fluoropentan-3-yloxy)-oxophosphanium?
The IUPAC name of bis(3-fluoropentan-3-yloxy)-oxophosphanium (CID 88634280) is bis(3-fluoropentan-3-yloxy)-oxophosphanium.
What is the SMILES notation for bis(3-fluoropentan-3-yloxy)-oxophosphanium?
The canonical SMILES for bis(3-fluoropentan-3-yloxy)-oxophosphanium is CCC(F)(CC)O[P+](=O)OC(F)(CC)CC.
What is the InChIKey of bis(3-fluoropentan-3-yloxy)-oxophosphanium?
The InChIKey is ZYFLQHYMKCLMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F2O3P/c1-5-9(11,6-2)14-16(13)15-10(12,7-3)8-4/h5-8H2,1-4H3/q+1.
What are the key properties of bis(3-fluoropentan-3-yloxy)-oxophosphanium?
bis(3-fluoropentan-3-yloxy)-oxophosphanium has a molecular weight of 257.24 g/mol, XLogP of 4.65, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3-fluoropentan-3-yloxy)-oxophosphanium is sourced from PubChem (CID 88634280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).