[chloro(methyl)phosphoryl]-methoxymethane

C3H8ClO2P — CID 130324170

IUPAC[chloro(methyl)phosphoryl]-methoxymethane
SMILESCOCP(C)(=O)Cl
InChIInChI=1S/C3H8ClO2P/c1-6-3-7(2,4)5/h3H2,1-2H3
InChIKeyXOIDTLVQQSIETE-UHFFFAOYSA-N
MW142.52 g/mol
LogP1.74
Rot. Bonds2

About [chloro(methyl)phosphoryl]-methoxymethane

[chloro(methyl)phosphoryl]-methoxymethane (PubChem CID 130324170) has the molecular formula C3H8ClO2P and a molecular weight of 142.52 g/mol. Its IUPAC name is [chloro(methyl)phosphoryl]-methoxymethane.

Molecular Properties

Compound Name[chloro(methyl)phosphoryl]-methoxymethane
PubChem CID130324170
Molecular FormulaC3H8ClO2P
Molecular Weight142.52 g/mol
Exact Mass142.00
IUPAC Name[chloro(methyl)phosphoryl]-methoxymethane
SMILESCOCP(C)(=O)Cl
InChIInChI=1S/C3H8ClO2P/c1-6-3-7(2,4)5/h3H2,1-2H3
InChIKeyXOIDTLVQQSIETE-UHFFFAOYSA-N
XLogP1.74
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.52
LogP ≤ 51.74
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]-methoxymethane?
The IUPAC name of [chloro(methyl)phosphoryl]-methoxymethane (CID 130324170) is [chloro(methyl)phosphoryl]-methoxymethane.
What is the SMILES notation for [chloro(methyl)phosphoryl]-methoxymethane?
The canonical SMILES for [chloro(methyl)phosphoryl]-methoxymethane is COCP(C)(=O)Cl.
What is the InChIKey of [chloro(methyl)phosphoryl]-methoxymethane?
The InChIKey is XOIDTLVQQSIETE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8ClO2P/c1-6-3-7(2,4)5/h3H2,1-2H3.
What are the key properties of [chloro(methyl)phosphoryl]-methoxymethane?
[chloro(methyl)phosphoryl]-methoxymethane has a molecular weight of 142.52 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [chloro(methyl)phosphoryl]-methoxymethane is sourced from PubChem (CID 130324170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).