dichlorophosphorylmethanol

CH3Cl2O2P — CID 130324841

IUPACdichlorophosphorylmethanol
SMILESO=P(Cl)(Cl)CO
InChIInChI=1S/CH3Cl2O2P/c2-6(3,5)1-4/h4H,1H2
InChIKeyLHHKMAVNJXNQDC-UHFFFAOYSA-N
MW148.91 g/mol
LogP1.61
Rot. Bonds1

About dichlorophosphorylmethanol

dichlorophosphorylmethanol (PubChem CID 130324841) has the molecular formula CH3Cl2O2P and a molecular weight of 148.91 g/mol. Its IUPAC name is dichlorophosphorylmethanol.

Molecular Properties

Compound Namedichlorophosphorylmethanol
PubChem CID130324841
Molecular FormulaCH3Cl2O2P
Molecular Weight148.91 g/mol
Exact Mass147.92
IUPAC Namedichlorophosphorylmethanol
SMILESO=P(Cl)(Cl)CO
InChIInChI=1S/CH3Cl2O2P/c2-6(3,5)1-4/h4H,1H2
InChIKeyLHHKMAVNJXNQDC-UHFFFAOYSA-N
XLogP1.61
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.91
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze dichlorophosphorylmethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[chloromethyl(hydroxymethyl)phosphoryl]methanol
CID 12572762
azane;hydroxymethylphosphonic acid
CID 175028252
bis(hydroxymethyl)phosphinic acid;zinc
CID 88775529
calcium phosphonatomethanol
CID 154632355
chlorophosphonic acid;lanthanum
CID 173408477
phosphoryl trichloride;sulfane
CID 159768251
dichlorophosphinic acid;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
CID 175359179
CID 162253126
CID 162253126
5-dichlorophosphoryl-2-methylpent-2-ene
CID 171108038
3-[chloro(methyl)phosphoryl]propanoyl chloride
CID 10943248
dichloromethane;methane;phosphoric acid
CID 174721529
azane;ethane-1,2-diol;phosphoric acid
CID 174794036

Frequently Asked Questions

What is the IUPAC name of dichlorophosphorylmethanol?
The IUPAC name of dichlorophosphorylmethanol (CID 130324841) is dichlorophosphorylmethanol.
What is the SMILES notation for dichlorophosphorylmethanol?
The canonical SMILES for dichlorophosphorylmethanol is O=P(Cl)(Cl)CO.
What is the InChIKey of dichlorophosphorylmethanol?
The InChIKey is LHHKMAVNJXNQDC-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3Cl2O2P/c2-6(3,5)1-4/h4H,1H2.
What are the key properties of dichlorophosphorylmethanol?
dichlorophosphorylmethanol has a molecular weight of 148.91 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorophosphorylmethanol is sourced from PubChem (CID 130324841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).