dimethoxy(oxo)phosphanium

C2H6O3P+ — CID 6327114

IUPACdimethoxy(oxo)phosphanium
SMILESCO[P+](=O)OC
InChIInChI=1S/C2H6O3P/c1-4-6(3)5-2/h1-2H3/q+1
InChIKeyYLFBFPXKTIQSSY-UHFFFAOYSA-N
MW109.04 g/mol
LogP0.94
Rot. Bonds2

About dimethoxy(oxo)phosphanium

dimethoxy(oxo)phosphanium (PubChem CID 6327114) has the molecular formula C2H6O3P+ and a molecular weight of 109.04 g/mol. Its IUPAC name is dimethoxy(oxo)phosphanium.

Molecular Properties

Compound Namedimethoxy(oxo)phosphanium
PubChem CID6327114
Molecular FormulaC2H6O3P+
Molecular Weight109.04 g/mol
Exact Mass109.00
IUPAC Namedimethoxy(oxo)phosphanium
SMILESCO[P+](=O)OC
InChIInChI=1S/C2H6O3P/c1-4-6(3)5-2/h1-2H3/q+1
InChIKeyYLFBFPXKTIQSSY-UHFFFAOYSA-N
XLogP0.94
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.04
LogP ≤ 50.94
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

Dimethyl phosphate
CID 13134
Trimethyl Phosphate
CID 10541
Dimethyl methylphosphonate
CID 12958
Phosphonic acid, dimethyl ester
CID 13361
Dimethyl fluorophosphate
CID 80052
Phosphorochloridic acid, dimethyl ester
CID 101863
Monomethyl methylphosphonate
CID 316552
Phosphonic acid, monomethyl ester
CID 6327900
Sodium methyl methylphosphonate
CID 21062327
Methyl methylphosphinate
CID 14184540
Dimethyl phosphate anion
CID 3753418
Methyl methylphosphonochloridate
CID 11499216

Frequently Asked Questions

What is the IUPAC name of dimethoxy(oxo)phosphanium?
The IUPAC name of dimethoxy(oxo)phosphanium (CID 6327114) is dimethoxy(oxo)phosphanium.
What is the SMILES notation for dimethoxy(oxo)phosphanium?
The canonical SMILES for dimethoxy(oxo)phosphanium is CO[P+](=O)OC.
What is the InChIKey of dimethoxy(oxo)phosphanium?
The InChIKey is YLFBFPXKTIQSSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O3P/c1-4-6(3)5-2/h1-2H3/q+1.
What are the key properties of dimethoxy(oxo)phosphanium?
dimethoxy(oxo)phosphanium has a molecular weight of 109.04 g/mol, XLogP of 0.94, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy(oxo)phosphanium is sourced from PubChem (CID 6327114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).