methyl-oxo-(trifluoromethyl)phosphanium

C2H3F3OP+ — CID 23235752

IUPACmethyl-oxo-(trifluoromethyl)phosphanium
SMILESC[P+](=O)C(F)(F)F
InChIInChI=1S/C2H3F3OP/c1-7(6)2(3,4)5/h1H3/q+1
InChIKeyGXBMWRWMDJUBHB-UHFFFAOYSA-N
MW131.01 g/mol
LogP1.96
Rot. Bonds

About methyl-oxo-(trifluoromethyl)phosphanium

methyl-oxo-(trifluoromethyl)phosphanium (PubChem CID 23235752) has the molecular formula C2H3F3OP+ and a molecular weight of 131.01 g/mol. Its IUPAC name is methyl-oxo-(trifluoromethyl)phosphanium.

Molecular Properties

Compound Namemethyl-oxo-(trifluoromethyl)phosphanium
PubChem CID23235752
Molecular FormulaC2H3F3OP+
Molecular Weight131.01 g/mol
Exact Mass130.99
IUPAC Namemethyl-oxo-(trifluoromethyl)phosphanium
SMILESC[P+](=O)C(F)(F)F
InChIInChI=1S/C2H3F3OP/c1-7(6)2(3,4)5/h1H3/q+1
InChIKeyGXBMWRWMDJUBHB-UHFFFAOYSA-N
XLogP1.96
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.01
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl-oxo-(trifluoromethyl)phosphanium?
The IUPAC name of methyl-oxo-(trifluoromethyl)phosphanium (CID 23235752) is methyl-oxo-(trifluoromethyl)phosphanium.
What is the SMILES notation for methyl-oxo-(trifluoromethyl)phosphanium?
The canonical SMILES for methyl-oxo-(trifluoromethyl)phosphanium is C[P+](=O)C(F)(F)F.
What is the InChIKey of methyl-oxo-(trifluoromethyl)phosphanium?
The InChIKey is GXBMWRWMDJUBHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3F3OP/c1-7(6)2(3,4)5/h1H3/q+1.
What are the key properties of methyl-oxo-(trifluoromethyl)phosphanium?
methyl-oxo-(trifluoromethyl)phosphanium has a molecular weight of 131.01 g/mol, XLogP of 1.96, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-oxo-(trifluoromethyl)phosphanium is sourced from PubChem (CID 23235752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).