[dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium

C4H10FO5P2+ — CID 130464175

IUPAC[dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium
SMILESCO[P+](=O)C(F)P(=O)(OC)OC
InChIInChI=1S/C4H10FO5P2/c1-8-11(6)4(5)12(7,9-2)10-3/h4H,1-3H3/q+1
InChIKeyTXXOCCFRBCPEPP-UHFFFAOYSA-N
MW219.06 g/mol
LogP2.11
Rot. Bonds5

About [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium

[dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium (PubChem CID 130464175) has the molecular formula C4H10FO5P2+ and a molecular weight of 219.06 g/mol. Its IUPAC name is [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium.

Molecular Properties

Compound Name[dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium
PubChem CID130464175
Molecular FormulaC4H10FO5P2+
Molecular Weight219.06 g/mol
Exact Mass219.00
IUPAC Name[dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium
SMILESCO[P+](=O)C(F)P(=O)(OC)OC
InChIInChI=1S/C4H10FO5P2/c1-8-11(6)4(5)12(7,9-2)10-3/h4H,1-3H3/q+1
InChIKeyTXXOCCFRBCPEPP-UHFFFAOYSA-N
XLogP2.11
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.06
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium?
The IUPAC name of [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium (CID 130464175) is [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium.
What is the SMILES notation for [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium?
The canonical SMILES for [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium is CO[P+](=O)C(F)P(=O)(OC)OC.
What is the InChIKey of [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium?
The InChIKey is TXXOCCFRBCPEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FO5P2/c1-8-11(6)4(5)12(7,9-2)10-3/h4H,1-3H3/q+1.
What are the key properties of [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium?
[dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium has a molecular weight of 219.06 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethoxyphosphoryl(fluoro)methyl]-methoxy-oxophosphanium is sourced from PubChem (CID 130464175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).