2-dimethylphosphorylethanone;tungsten

C4H8O2PW- — CID 59915861

IUPAC2-dimethylphosphorylethanone;tungsten
SMILESCP(C)(=O)C[C-]=O.[W]
InChIInChI=1S/C4H8O2P.W/c1-7(2,6)4-3-5;/h4H2,1-2H3;/q-1;
InChIKeyPEDXXUYIGQKDCC-UHFFFAOYSA-N
MW302.92 g/mol
LogP0.72
Rot. Bonds2

About 2-dimethylphosphorylethanone;tungsten

2-dimethylphosphorylethanone;tungsten (PubChem CID 59915861) has the molecular formula C4H8O2PW- and a molecular weight of 302.92 g/mol. Its IUPAC name is 2-dimethylphosphorylethanone;tungsten.

Molecular Properties

Compound Name2-dimethylphosphorylethanone;tungsten
PubChem CID59915861
Molecular FormulaC4H8O2PW-
Molecular Weight302.92 g/mol
Exact Mass302.98
IUPAC Name2-dimethylphosphorylethanone;tungsten
SMILESCP(C)(=O)C[C-]=O.[W]
InChIInChI=1S/C4H8O2P.W/c1-7(2,6)4-3-5;/h4H2,1-2H3;/q-1;
InChIKeyPEDXXUYIGQKDCC-UHFFFAOYSA-N
XLogP0.72
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.92
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-dimethylphosphorylethanone;tungsten?
The IUPAC name of 2-dimethylphosphorylethanone;tungsten (CID 59915861) is 2-dimethylphosphorylethanone;tungsten.
What is the SMILES notation for 2-dimethylphosphorylethanone;tungsten?
The canonical SMILES for 2-dimethylphosphorylethanone;tungsten is CP(C)(=O)C[C-]=O.[W].
What is the InChIKey of 2-dimethylphosphorylethanone;tungsten?
The InChIKey is PEDXXUYIGQKDCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O2P.W/c1-7(2,6)4-3-5;/h4H2,1-2H3;/q-1;.
What are the key properties of 2-dimethylphosphorylethanone;tungsten?
2-dimethylphosphorylethanone;tungsten has a molecular weight of 302.92 g/mol, XLogP of 0.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dimethylphosphorylethanone;tungsten is sourced from PubChem (CID 59915861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).