bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane

C24H33P — CID 21490565

IUPACbis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane
SMILESC=Cc1cc(C=C)c(C=C)c(P(C2CCC(C)C2)C2CCC(C)C2)c1
InChIInChI=1S/C24H33P/c1-6-19-15-20(7-2)23(8-3)24(16-19)25(21-11-9-17(4)13-21)22-12-10-18(5)14-22/h6-8,15-18,21-22H,1-3,9-14H2,4-5H3
InChIKeyPFMDXSCHDALSQC-UHFFFAOYSA-N
MW352.50 g/mol
LogP7.10
Rot. Bonds6

About bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane

bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane (PubChem CID 21490565) has the molecular formula C24H33P and a molecular weight of 352.50 g/mol. Its IUPAC name is bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane.

Molecular Properties

Compound Namebis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane
PubChem CID21490565
Molecular FormulaC24H33P
Molecular Weight352.50 g/mol
Exact Mass352.23
IUPAC Namebis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane
SMILESC=Cc1cc(C=C)c(C=C)c(P(C2CCC(C)C2)C2CCC(C)C2)c1
InChIInChI=1S/C24H33P/c1-6-19-15-20(7-2)23(8-3)24(16-19)25(21-11-9-17(4)13-21)22-12-10-18(5)14-22/h6-8,15-18,21-22H,1-3,9-14H2,4-5H3
InChIKeyPFMDXSCHDALSQC-UHFFFAOYSA-N
XLogP7.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.50
LogP ≤ 57.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane?
The IUPAC name of bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane (CID 21490565) is bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane.
What is the SMILES notation for bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane?
The canonical SMILES for bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane is C=Cc1cc(C=C)c(C=C)c(P(C2CCC(C)C2)C2CCC(C)C2)c1.
What is the InChIKey of bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane?
The InChIKey is PFMDXSCHDALSQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33P/c1-6-19-15-20(7-2)23(8-3)24(16-19)25(21-11-9-17(4)13-21)22-12-10-18(5)14-22/h6-8,15-18,21-22H,1-3,9-14H2,4-5H3.
What are the key properties of bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane?
bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane has a molecular weight of 352.50 g/mol, XLogP of 7.10, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3-methylcyclopentyl)-[2,3,5-tris(ethenyl)phenyl]phosphane is sourced from PubChem (CID 21490565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).