[chloro(methyl)phosphoryl]oxymethane

C2H6ClO2P — CID 11499216

IUPAC[chloro(methyl)phosphoryl]oxymethane
SMILESCOP(C)(=O)Cl
InChIInChI=1S/C2H6ClO2P/c1-5-6(2,3)4/h1-2H3
InChIKeyKKHPDGYJSLZVFZ-UHFFFAOYSA-N
MW128.49 g/mol
LogP1.69
Rot. Bonds1

About [chloro(methyl)phosphoryl]oxymethane

[chloro(methyl)phosphoryl]oxymethane (PubChem CID 11499216) has the molecular formula C2H6ClO2P and a molecular weight of 128.49 g/mol. Its IUPAC name is [chloro(methyl)phosphoryl]oxymethane.

Molecular Properties

Compound Name[chloro(methyl)phosphoryl]oxymethane
PubChem CID11499216
Molecular FormulaC2H6ClO2P
Molecular Weight128.49 g/mol
Exact Mass127.98
IUPAC Name[chloro(methyl)phosphoryl]oxymethane
SMILESCOP(C)(=O)Cl
InChIInChI=1S/C2H6ClO2P/c1-5-6(2,3)4/h1-2H3
InChIKeyKKHPDGYJSLZVFZ-UHFFFAOYSA-N
XLogP1.69
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.49
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [chloro(methyl)phosphoryl]oxymethane?
The IUPAC name of [chloro(methyl)phosphoryl]oxymethane (CID 11499216) is [chloro(methyl)phosphoryl]oxymethane.
What is the SMILES notation for [chloro(methyl)phosphoryl]oxymethane?
The canonical SMILES for [chloro(methyl)phosphoryl]oxymethane is COP(C)(=O)Cl.
What is the InChIKey of [chloro(methyl)phosphoryl]oxymethane?
The InChIKey is KKHPDGYJSLZVFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6ClO2P/c1-5-6(2,3)4/h1-2H3.
What are the key properties of [chloro(methyl)phosphoryl]oxymethane?
[chloro(methyl)phosphoryl]oxymethane has a molecular weight of 128.49 g/mol, XLogP of 1.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [chloro(methyl)phosphoryl]oxymethane is sourced from PubChem (CID 11499216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).