[chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane

C2H6Cl2O3P2 — CID 10987550

IUPAC[chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane
SMILESCP(=O)(Cl)OP(C)(=O)Cl
InChIInChI=1S/C2H6Cl2O3P2/c1-8(3,5)7-9(2,4)6/h1-2H3
InChIKeyAABOGCYAFPCBMY-UHFFFAOYSA-N
MW210.92 g/mol
LogP3.13
Rot. Bonds2

About [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane

[chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane (PubChem CID 10987550) has the molecular formula C2H6Cl2O3P2 and a molecular weight of 210.92 g/mol. Its IUPAC name is [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane.

Molecular Properties

Compound Name[chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane
PubChem CID10987550
Molecular FormulaC2H6Cl2O3P2
Molecular Weight210.92 g/mol
Exact Mass209.92
IUPAC Name[chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane
SMILESCP(=O)(Cl)OP(C)(=O)Cl
InChIInChI=1S/C2H6Cl2O3P2/c1-8(3,5)7-9(2,4)6/h1-2H3
InChIKeyAABOGCYAFPCBMY-UHFFFAOYSA-N
XLogP3.13
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.92
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Methyl-[methyl(oxo)phosphaniumyl]oxy-oxophosphanium
CID 76700229
[Chloro(dichlorophosphoryloxy)phosphoryl]methane
CID 88896383
Chloro-[chloro(methyl)phosphoryl]oxy-oxophosphanium
CID 152697602
Sodium;dimethylphosphinate;phosphoryl trichloride
CID 157123348
Methyl-oxido-oxophosphanium;dihydrochloride
CID 172732795

Frequently Asked Questions

What is the IUPAC name of [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane?
The IUPAC name of [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane (CID 10987550) is [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane.
What is the SMILES notation for [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane?
The canonical SMILES for [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane is CP(=O)(Cl)OP(C)(=O)Cl.
What is the InChIKey of [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane?
The InChIKey is AABOGCYAFPCBMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6Cl2O3P2/c1-8(3,5)7-9(2,4)6/h1-2H3.
What are the key properties of [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane?
[chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane has a molecular weight of 210.92 g/mol, XLogP of 3.13, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [chloro-[chloro(methyl)phosphoryl]oxyphosphoryl]methane is sourced from PubChem (CID 10987550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).