[methanidyl(methoxy)phosphoryl]oxymethane

C3H8O3P- — CID 23416631

IUPAC[methanidyl(methoxy)phosphoryl]oxymethane
SMILES[CH2-]P(=O)(OC)OC
InChIInChI=1S/C3H8O3P/c1-5-7(3,4)6-2/h3H2,1-2H3/q-1
InChIKeyAWVSJKRZUSIZEF-UHFFFAOYSA-N
MW123.07 g/mol
LogP1.26
Rot. Bonds2

About [methanidyl(methoxy)phosphoryl]oxymethane

[methanidyl(methoxy)phosphoryl]oxymethane (PubChem CID 23416631) has the molecular formula C3H8O3P- and a molecular weight of 123.07 g/mol. Its IUPAC name is [methanidyl(methoxy)phosphoryl]oxymethane.

Molecular Properties

Compound Name[methanidyl(methoxy)phosphoryl]oxymethane
PubChem CID23416631
Molecular FormulaC3H8O3P-
Molecular Weight123.07 g/mol
Exact Mass123.02
IUPAC Name[methanidyl(methoxy)phosphoryl]oxymethane
SMILES[CH2-]P(=O)(OC)OC
InChIInChI=1S/C3H8O3P/c1-5-7(3,4)6-2/h3H2,1-2H3/q-1
InChIKeyAWVSJKRZUSIZEF-UHFFFAOYSA-N
XLogP1.26
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.07
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [methanidyl(methoxy)phosphoryl]oxymethane?
The IUPAC name of [methanidyl(methoxy)phosphoryl]oxymethane (CID 23416631) is [methanidyl(methoxy)phosphoryl]oxymethane.
What is the SMILES notation for [methanidyl(methoxy)phosphoryl]oxymethane?
The canonical SMILES for [methanidyl(methoxy)phosphoryl]oxymethane is [CH2-]P(=O)(OC)OC.
What is the InChIKey of [methanidyl(methoxy)phosphoryl]oxymethane?
The InChIKey is AWVSJKRZUSIZEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O3P/c1-5-7(3,4)6-2/h3H2,1-2H3/q-1.
What are the key properties of [methanidyl(methoxy)phosphoryl]oxymethane?
[methanidyl(methoxy)phosphoryl]oxymethane has a molecular weight of 123.07 g/mol, XLogP of 1.26, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [methanidyl(methoxy)phosphoryl]oxymethane is sourced from PubChem (CID 23416631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).