methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane

C21H29PSi — CID 59371973

IUPACmethylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane
SMILESC=P(c1ccccc1)(c1ccccc1)C1CCC([Si](C)(C)C)C1
InChIInChI=1S/C21H29PSi/c1-22(18-11-7-5-8-12-18,19-13-9-6-10-14-19)20-15-16-21(17-20)23(2,3)4/h5-14,20-21H,1,15-17H2,2-4H3
InChIKeyIKMHQODOENPJFS-UHFFFAOYSA-N
MW340.52 g/mol
LogP5.35
Rot. Bonds4

About methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane

methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane (PubChem CID 59371973) has the molecular formula C21H29PSi and a molecular weight of 340.52 g/mol. Its IUPAC name is methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane.

Molecular Properties

Compound Namemethylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane
PubChem CID59371973
Molecular FormulaC21H29PSi
Molecular Weight340.52 g/mol
Exact Mass340.18
IUPAC Namemethylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane
SMILESC=P(c1ccccc1)(c1ccccc1)C1CCC([Si](C)(C)C)C1
InChIInChI=1S/C21H29PSi/c1-22(18-11-7-5-8-12-18,19-13-9-6-10-14-19)20-15-16-21(17-20)23(2,3)4/h5-14,20-21H,1,15-17H2,2-4H3
InChIKeyIKMHQODOENPJFS-UHFFFAOYSA-N
XLogP5.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.52
LogP ≤ 55.35
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 methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane?
The IUPAC name of methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane (CID 59371973) is methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane.
What is the SMILES notation for methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane?
The canonical SMILES for methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane is C=P(c1ccccc1)(c1ccccc1)C1CCC([Si](C)(C)C)C1.
What is the InChIKey of methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane?
The InChIKey is IKMHQODOENPJFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29PSi/c1-22(18-11-7-5-8-12-18,19-13-9-6-10-14-19)20-15-16-21(17-20)23(2,3)4/h5-14,20-21H,1,15-17H2,2-4H3.
What are the key properties of methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane?
methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane has a molecular weight of 340.52 g/mol, XLogP of 5.35, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methylidene-diphenyl-(3-trimethylsilylcyclopentyl)-λ5-phosphane is sourced from PubChem (CID 59371973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).