[iodo(methoxy)phosphoryl]oxymethane

C2H6IO3P — CID 14593808

IUPAC[iodo(methoxy)phosphoryl]oxymethane
SMILESCOP(=O)(I)OC
InChIInChI=1S/C2H6IO3P/c1-5-7(3,4)6-2/h1-2H3
InChIKeyKNBKCHQIENLTBD-UHFFFAOYSA-N
MW235.94 g/mol
LogP1.82
Rot. Bonds2

About [iodo(methoxy)phosphoryl]oxymethane

[iodo(methoxy)phosphoryl]oxymethane (PubChem CID 14593808) has the molecular formula C2H6IO3P and a molecular weight of 235.94 g/mol. Its IUPAC name is [iodo(methoxy)phosphoryl]oxymethane.

Molecular Properties

Compound Name[iodo(methoxy)phosphoryl]oxymethane
PubChem CID14593808
Molecular FormulaC2H6IO3P
Molecular Weight235.94 g/mol
Exact Mass235.91
IUPAC Name[iodo(methoxy)phosphoryl]oxymethane
SMILESCOP(=O)(I)OC
InChIInChI=1S/C2H6IO3P/c1-5-7(3,4)6-2/h1-2H3
InChIKeyKNBKCHQIENLTBD-UHFFFAOYSA-N
XLogP1.82
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.94
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [iodo(methoxy)phosphoryl]oxymethane?
The IUPAC name of [iodo(methoxy)phosphoryl]oxymethane (CID 14593808) is [iodo(methoxy)phosphoryl]oxymethane.
What is the SMILES notation for [iodo(methoxy)phosphoryl]oxymethane?
The canonical SMILES for [iodo(methoxy)phosphoryl]oxymethane is COP(=O)(I)OC.
What is the InChIKey of [iodo(methoxy)phosphoryl]oxymethane?
The InChIKey is KNBKCHQIENLTBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6IO3P/c1-5-7(3,4)6-2/h1-2H3.
What are the key properties of [iodo(methoxy)phosphoryl]oxymethane?
[iodo(methoxy)phosphoryl]oxymethane has a molecular weight of 235.94 g/mol, XLogP of 1.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [iodo(methoxy)phosphoryl]oxymethane is sourced from PubChem (CID 14593808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).