bis(1,1-diphenylprop-2-enyl)phosphane

C30H27P — CID 67252408

IUPACbis(1,1-diphenylprop-2-enyl)phosphane
SMILESC=CC(PC(C=C)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H27P/c1-3-29(25-17-9-5-10-18-25,26-19-11-6-12-20-26)31-30(4-2,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h3-24,31H,1-2H2
InChIKeyIBRLXHYPJZBEMY-UHFFFAOYSA-N
MW418.52 g/mol
LogP7.92
Rot. Bonds8

About bis(1,1-diphenylprop-2-enyl)phosphane

bis(1,1-diphenylprop-2-enyl)phosphane (PubChem CID 67252408) has the molecular formula C30H27P and a molecular weight of 418.52 g/mol. Its IUPAC name is bis(1,1-diphenylprop-2-enyl)phosphane.

Molecular Properties

Compound Namebis(1,1-diphenylprop-2-enyl)phosphane
PubChem CID67252408
Molecular FormulaC30H27P
Molecular Weight418.52 g/mol
Exact Mass418.19
IUPAC Namebis(1,1-diphenylprop-2-enyl)phosphane
SMILESC=CC(PC(C=C)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H27P/c1-3-29(25-17-9-5-10-18-25,26-19-11-6-12-20-26)31-30(4-2,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h3-24,31H,1-2H2
InChIKeyIBRLXHYPJZBEMY-UHFFFAOYSA-N
XLogP7.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.52
LogP ≤ 57.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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1-(1-amino-1-phenylprop-2-enoxy)-1-phenylprop-2-en-1-amine
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CID 135081440
CID 135081440
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[(2R)-2-prop-2-enoxypent-4-en-2-yl]benzene
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(1-ethenyl-1-phenylprop-2-enoxy)benzene
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2,2-diphenylpropanedial
CID 15324204
2-ethenyl-2-phenylbut-3-enamide
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prop-2-enyl 2-hydroxy-2,3-diphenylpropanoate
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Frequently Asked Questions

What is the IUPAC name of bis(1,1-diphenylprop-2-enyl)phosphane?
The IUPAC name of bis(1,1-diphenylprop-2-enyl)phosphane (CID 67252408) is bis(1,1-diphenylprop-2-enyl)phosphane.
What is the SMILES notation for bis(1,1-diphenylprop-2-enyl)phosphane?
The canonical SMILES for bis(1,1-diphenylprop-2-enyl)phosphane is C=CC(PC(C=C)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of bis(1,1-diphenylprop-2-enyl)phosphane?
The InChIKey is IBRLXHYPJZBEMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H27P/c1-3-29(25-17-9-5-10-18-25,26-19-11-6-12-20-26)31-30(4-2,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h3-24,31H,1-2H2.
What are the key properties of bis(1,1-diphenylprop-2-enyl)phosphane?
bis(1,1-diphenylprop-2-enyl)phosphane has a molecular weight of 418.52 g/mol, XLogP of 7.92, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1,1-diphenylprop-2-enyl)phosphane is sourced from PubChem (CID 67252408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).