methyl-oxido-oxophosphanium;dihydrochloride

CH5Cl2O2P — CID 172732795

IUPACmethyl-oxido-oxophosphanium;dihydrochloride
SMILESC[P+](=O)[O-].Cl.Cl
InChIInChI=1S/CH3O2P.2ClH/c1-4(2)3;;/h1H3;2*1H
InChIKeyIAFNLHCNGMQCBA-UHFFFAOYSA-N
MW150.93 g/mol
LogP0.56
Rot. Bonds

About methyl-oxido-oxophosphanium;dihydrochloride

methyl-oxido-oxophosphanium;dihydrochloride (PubChem CID 172732795) has the molecular formula CH5Cl2O2P and a molecular weight of 150.93 g/mol. Its IUPAC name is methyl-oxido-oxophosphanium;dihydrochloride.

Molecular Properties

Compound Namemethyl-oxido-oxophosphanium;dihydrochloride
PubChem CID172732795
Molecular FormulaCH5Cl2O2P
Molecular Weight150.93 g/mol
Exact Mass149.94
IUPAC Namemethyl-oxido-oxophosphanium;dihydrochloride
SMILESC[P+](=O)[O-].Cl.Cl
InChIInChI=1S/CH3O2P.2ClH/c1-4(2)3;;/h1H3;2*1H
InChIKeyIAFNLHCNGMQCBA-UHFFFAOYSA-N
XLogP0.56
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.93
LogP ≤ 50.56
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 methyl-oxido-oxophosphanium;dihydrochloride?
The IUPAC name of methyl-oxido-oxophosphanium;dihydrochloride (CID 172732795) is methyl-oxido-oxophosphanium;dihydrochloride.
What is the SMILES notation for methyl-oxido-oxophosphanium;dihydrochloride?
The canonical SMILES for methyl-oxido-oxophosphanium;dihydrochloride is C[P+](=O)[O-].Cl.Cl.
What is the InChIKey of methyl-oxido-oxophosphanium;dihydrochloride?
The InChIKey is IAFNLHCNGMQCBA-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3O2P.2ClH/c1-4(2)3;;/h1H3;2*1H.
What are the key properties of methyl-oxido-oxophosphanium;dihydrochloride?
methyl-oxido-oxophosphanium;dihydrochloride has a molecular weight of 150.93 g/mol, XLogP of 0.56, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-oxido-oxophosphanium;dihydrochloride is sourced from PubChem (CID 172732795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).