[chloro(methyl)phosphoryl]peroxymethane

C2H6ClO3P — CID 141034633

IUPAC[chloro(methyl)phosphoryl]peroxymethane
SMILESCOOP(C)(=O)Cl
InChIInChI=1S/C2H6ClO3P/c1-5-6-7(2,3)4/h1-2H3
InChIKeySONYJVQIWMLDTD-UHFFFAOYSA-N
MW144.49 g/mol
LogP1.63
Rot. Bonds2

About [chloro(methyl)phosphoryl]peroxymethane

[chloro(methyl)phosphoryl]peroxymethane (PubChem CID 141034633) has the molecular formula C2H6ClO3P and a molecular weight of 144.49 g/mol. Its IUPAC name is [chloro(methyl)phosphoryl]peroxymethane.

Molecular Properties

Compound Name[chloro(methyl)phosphoryl]peroxymethane
PubChem CID141034633
Molecular FormulaC2H6ClO3P
Molecular Weight144.49 g/mol
Exact Mass143.97
IUPAC Name[chloro(methyl)phosphoryl]peroxymethane
SMILESCOOP(C)(=O)Cl
InChIInChI=1S/C2H6ClO3P/c1-5-6-7(2,3)4/h1-2H3
InChIKeySONYJVQIWMLDTD-UHFFFAOYSA-N
XLogP1.63
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.49
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [chloro(methyl)phosphoryl]peroxymethane?
The IUPAC name of [chloro(methyl)phosphoryl]peroxymethane (CID 141034633) is [chloro(methyl)phosphoryl]peroxymethane.
What is the SMILES notation for [chloro(methyl)phosphoryl]peroxymethane?
The canonical SMILES for [chloro(methyl)phosphoryl]peroxymethane is COOP(C)(=O)Cl.
What is the InChIKey of [chloro(methyl)phosphoryl]peroxymethane?
The InChIKey is SONYJVQIWMLDTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6ClO3P/c1-5-6-7(2,3)4/h1-2H3.
What are the key properties of [chloro(methyl)phosphoryl]peroxymethane?
[chloro(methyl)phosphoryl]peroxymethane has a molecular weight of 144.49 g/mol, XLogP of 1.63, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [chloro(methyl)phosphoryl]peroxymethane is sourced from PubChem (CID 141034633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).