sodium;dimethylphosphinate;phosphoryl trichloride

C2H6Cl3NaO3P2 — CID 157123348

IUPACsodium;dimethylphosphinate;phosphoryl trichloride
SMILESCP(C)(=O)[O-].O=P(Cl)(Cl)Cl.[Na+]
InChIInChI=1S/C2H7O2P.Cl3OP.Na/c2*1-5(2,3)4;/h1-2H3,(H,3,4);;/q;;+1/p-1
InChIKeyMSBKIWPDFXFWCW-UHFFFAOYSA-M
MW269.36 g/mol
LogP-0.30
Rot. Bonds

About sodium;dimethylphosphinate;phosphoryl trichloride

sodium;dimethylphosphinate;phosphoryl trichloride (PubChem CID 157123348) has the molecular formula C2H6Cl3NaO3P2 and a molecular weight of 269.36 g/mol. Its IUPAC name is sodium;dimethylphosphinate;phosphoryl trichloride.

Molecular Properties

Compound Namesodium;dimethylphosphinate;phosphoryl trichloride
PubChem CID157123348
Molecular FormulaC2H6Cl3NaO3P2
Molecular Weight269.36 g/mol
Exact Mass267.88
IUPAC Namesodium;dimethylphosphinate;phosphoryl trichloride
SMILESCP(C)(=O)[O-].O=P(Cl)(Cl)Cl.[Na+]
InChIInChI=1S/C2H7O2P.Cl3OP.Na/c2*1-5(2,3)4;/h1-2H3,(H,3,4);;/q;;+1/p-1
InChIKeyMSBKIWPDFXFWCW-UHFFFAOYSA-M
XLogP-0.30
TPSA57.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.36
LogP ≤ 5-0.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of sodium;dimethylphosphinate;phosphoryl trichloride?
The IUPAC name of sodium;dimethylphosphinate;phosphoryl trichloride (CID 157123348) is sodium;dimethylphosphinate;phosphoryl trichloride.
What is the SMILES notation for sodium;dimethylphosphinate;phosphoryl trichloride?
The canonical SMILES for sodium;dimethylphosphinate;phosphoryl trichloride is CP(C)(=O)[O-].O=P(Cl)(Cl)Cl.[Na+].
What is the InChIKey of sodium;dimethylphosphinate;phosphoryl trichloride?
The InChIKey is MSBKIWPDFXFWCW-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H7O2P.Cl3OP.Na/c2*1-5(2,3)4;/h1-2H3,(H,3,4);;/q;;+1/p-1.
What are the key properties of sodium;dimethylphosphinate;phosphoryl trichloride?
sodium;dimethylphosphinate;phosphoryl trichloride has a molecular weight of 269.36 g/mol, XLogP of -0.30, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;dimethylphosphinate;phosphoryl trichloride is sourced from PubChem (CID 157123348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).