benzyl-tris(3-phenylpropyl)silane

C34H40Si — CID 4154799

IUPACbenzyl-tris(3-phenylpropyl)silane
SMILESc1ccc(CCC[Si](CCCc2ccccc2)(CCCc2ccccc2)Cc2ccccc2)cc1
InChIInChI=1S/C34H40Si/c1-5-16-31(17-6-1)24-13-27-35(30-34-22-11-4-12-23-34,28-14-25-32-18-7-2-8-19-32)29-15-26-33-20-9-3-10-21-33/h1-12,16-23H,13-15,24-30H2
InChIKeyFMNDOOUQCILDPG-UHFFFAOYSA-N
MW476.78 g/mol
LogP9.12
Rot. Bonds14

About benzyl-tris(3-phenylpropyl)silane

benzyl-tris(3-phenylpropyl)silane (PubChem CID 4154799) has the molecular formula C34H40Si and a molecular weight of 476.78 g/mol. Its IUPAC name is benzyl-tris(3-phenylpropyl)silane.

Molecular Properties

Compound Namebenzyl-tris(3-phenylpropyl)silane
PubChem CID4154799
Molecular FormulaC34H40Si
Molecular Weight476.78 g/mol
Exact Mass476.29
IUPAC Namebenzyl-tris(3-phenylpropyl)silane
SMILESc1ccc(CCC[Si](CCCc2ccccc2)(CCCc2ccccc2)Cc2ccccc2)cc1
InChIInChI=1S/C34H40Si/c1-5-16-31(17-6-1)24-13-27-35(30-34-22-11-4-12-23-34,28-14-25-32-18-7-2-8-19-32)29-15-26-33-20-9-3-10-21-33/h1-12,16-23H,13-15,24-30H2
InChIKeyFMNDOOUQCILDPG-UHFFFAOYSA-N
XLogP9.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.78
LogP ≤ 59.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of benzyl-tris(3-phenylpropyl)silane?
The IUPAC name of benzyl-tris(3-phenylpropyl)silane (CID 4154799) is benzyl-tris(3-phenylpropyl)silane.
What is the SMILES notation for benzyl-tris(3-phenylpropyl)silane?
The canonical SMILES for benzyl-tris(3-phenylpropyl)silane is c1ccc(CCC[Si](CCCc2ccccc2)(CCCc2ccccc2)Cc2ccccc2)cc1.
What is the InChIKey of benzyl-tris(3-phenylpropyl)silane?
The InChIKey is FMNDOOUQCILDPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H40Si/c1-5-16-31(17-6-1)24-13-27-35(30-34-22-11-4-12-23-34,28-14-25-32-18-7-2-8-19-32)29-15-26-33-20-9-3-10-21-33/h1-12,16-23H,13-15,24-30H2.
What are the key properties of benzyl-tris(3-phenylpropyl)silane?
benzyl-tris(3-phenylpropyl)silane has a molecular weight of 476.78 g/mol, XLogP of 9.12, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl-tris(3-phenylpropyl)silane is sourced from PubChem (CID 4154799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).