diphenylphosphane;zinc

C12H11PZn — CID 160591319

IUPACdiphenylphosphane;zinc
SMILES[Zn].c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C12H11P.Zn/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-10,13H;
InChIKeyRDBDASZMDVIBKX-UHFFFAOYSA-N
MW251.58 g/mol
LogP2.31
Rot. Bonds2

About diphenylphosphane;zinc

diphenylphosphane;zinc (PubChem CID 160591319) has the molecular formula C12H11PZn and a molecular weight of 251.58 g/mol. Its IUPAC name is diphenylphosphane;zinc.

Molecular Properties

Compound Namediphenylphosphane;zinc
PubChem CID160591319
Molecular FormulaC12H11PZn
Molecular Weight251.58 g/mol
Exact Mass249.99
IUPAC Namediphenylphosphane;zinc
SMILES[Zn].c1ccc(Pc2ccccc2)cc1
InChIInChI=1S/C12H11P.Zn/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-10,13H;
InChIKeyRDBDASZMDVIBKX-UHFFFAOYSA-N
XLogP2.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.58
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diphenylphosphane;zinc?
The IUPAC name of diphenylphosphane;zinc (CID 160591319) is diphenylphosphane;zinc.
What is the SMILES notation for diphenylphosphane;zinc?
The canonical SMILES for diphenylphosphane;zinc is [Zn].c1ccc(Pc2ccccc2)cc1.
What is the InChIKey of diphenylphosphane;zinc?
The InChIKey is RDBDASZMDVIBKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11P.Zn/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-10,13H;.
What are the key properties of diphenylphosphane;zinc?
diphenylphosphane;zinc has a molecular weight of 251.58 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylphosphane;zinc is sourced from PubChem (CID 160591319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).