diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane

C20H19PSe — CID 132605440

IUPACdiphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane
SMILES[Se]=P(CCc1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H19PSe/c22-21(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-16-18-10-4-1-5-11-18/h1-15H,16-17H2
InChIKeyHZIUYSIGKCHYDY-UHFFFAOYSA-N
MW369.31 g/mol
LogP3.98
Rot. Bonds5

About diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane

diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane (PubChem CID 132605440) has the molecular formula C20H19PSe and a molecular weight of 369.31 g/mol. Its IUPAC name is diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane.

Molecular Properties

Compound Namediphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane
PubChem CID132605440
Molecular FormulaC20H19PSe
Molecular Weight369.31 g/mol
Exact Mass370.04
IUPAC Namediphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane
SMILES[Se]=P(CCc1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H19PSe/c22-21(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-16-18-10-4-1-5-11-18/h1-15H,16-17H2
InChIKeyHZIUYSIGKCHYDY-UHFFFAOYSA-N
XLogP3.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.31
LogP ≤ 53.98
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 diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane?
The IUPAC name of diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane (CID 132605440) is diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane.
What is the SMILES notation for diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane?
The canonical SMILES for diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane is [Se]=P(CCc1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane?
The InChIKey is HZIUYSIGKCHYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19PSe/c22-21(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-16-18-10-4-1-5-11-18/h1-15H,16-17H2.
What are the key properties of diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane?
diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane has a molecular weight of 369.31 g/mol, XLogP of 3.98, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(2-phenylethyl)-selanylidene-λ5-phosphane is sourced from PubChem (CID 132605440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).