bis(4-ethenylphenyl)-pyridin-2-ylphosphane

C21H18NP — CID 122653862

IUPACbis(4-ethenylphenyl)-pyridin-2-ylphosphane
SMILESC=Cc1ccc(P(c2ccc(C=C)cc2)c2ccccn2)cc1
InChIInChI=1S/C21H18NP/c1-3-17-8-12-19(13-9-17)23(21-7-5-6-16-22-21)20-14-10-18(4-2)11-15-20/h3-16H,1-2H2
InChIKeyFEVNUUQECHLQTB-UHFFFAOYSA-N
MW315.36 g/mol
LogP4.13
Rot. Bonds5

About bis(4-ethenylphenyl)-pyridin-2-ylphosphane

bis(4-ethenylphenyl)-pyridin-2-ylphosphane (PubChem CID 122653862) has the molecular formula C21H18NP and a molecular weight of 315.36 g/mol. Its IUPAC name is bis(4-ethenylphenyl)-pyridin-2-ylphosphane.

Molecular Properties

Compound Namebis(4-ethenylphenyl)-pyridin-2-ylphosphane
PubChem CID122653862
Molecular FormulaC21H18NP
Molecular Weight315.36 g/mol
Exact Mass315.12
IUPAC Namebis(4-ethenylphenyl)-pyridin-2-ylphosphane
SMILESC=Cc1ccc(P(c2ccc(C=C)cc2)c2ccccn2)cc1
InChIInChI=1S/C21H18NP/c1-3-17-8-12-19(13-9-17)23(21-7-5-6-16-22-21)20-14-10-18(4-2)11-15-20/h3-16H,1-2H2
InChIKeyFEVNUUQECHLQTB-UHFFFAOYSA-N
XLogP4.13
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.36
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(4-ethenylphenyl)-pyridin-2-ylphosphane?
The IUPAC name of bis(4-ethenylphenyl)-pyridin-2-ylphosphane (CID 122653862) is bis(4-ethenylphenyl)-pyridin-2-ylphosphane.
What is the SMILES notation for bis(4-ethenylphenyl)-pyridin-2-ylphosphane?
The canonical SMILES for bis(4-ethenylphenyl)-pyridin-2-ylphosphane is C=Cc1ccc(P(c2ccc(C=C)cc2)c2ccccn2)cc1.
What is the InChIKey of bis(4-ethenylphenyl)-pyridin-2-ylphosphane?
The InChIKey is FEVNUUQECHLQTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18NP/c1-3-17-8-12-19(13-9-17)23(21-7-5-6-16-22-21)20-14-10-18(4-2)11-15-20/h3-16H,1-2H2.
What are the key properties of bis(4-ethenylphenyl)-pyridin-2-ylphosphane?
bis(4-ethenylphenyl)-pyridin-2-ylphosphane has a molecular weight of 315.36 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-ethenylphenyl)-pyridin-2-ylphosphane is sourced from PubChem (CID 122653862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).