tris(2-cyclohexylethyl)-phenylsilane

C30H50Si — CID 4146190

IUPACtris(2-cyclohexylethyl)-phenylsilane
SMILESc1ccc([Si](CCC2CCCCC2)(CCC2CCCCC2)CCC2CCCCC2)cc1
InChIInChI=1S/C30H50Si/c1-5-13-27(14-6-1)21-24-31(30-19-11-4-12-20-30,25-22-28-15-7-2-8-16-28)26-23-29-17-9-3-10-18-29/h4,11-12,19-20,27-29H,1-3,5-10,13-18,21-26H2
InChIKeyLSYOLVSDLNXJQR-UHFFFAOYSA-N
MW438.82 g/mol
LogP9.25
Rot. Bonds10

About tris(2-cyclohexylethyl)-phenylsilane

tris(2-cyclohexylethyl)-phenylsilane (PubChem CID 4146190) has the molecular formula C30H50Si and a molecular weight of 438.82 g/mol. Its IUPAC name is tris(2-cyclohexylethyl)-phenylsilane.

Molecular Properties

Compound Nametris(2-cyclohexylethyl)-phenylsilane
PubChem CID4146190
Molecular FormulaC30H50Si
Molecular Weight438.82 g/mol
Exact Mass438.37
IUPAC Nametris(2-cyclohexylethyl)-phenylsilane
SMILESc1ccc([Si](CCC2CCCCC2)(CCC2CCCCC2)CCC2CCCCC2)cc1
InChIInChI=1S/C30H50Si/c1-5-13-27(14-6-1)21-24-31(30-19-11-4-12-20-30,25-22-28-15-7-2-8-16-28)26-23-29-17-9-3-10-18-29/h4,11-12,19-20,27-29H,1-3,5-10,13-18,21-26H2
InChIKeyLSYOLVSDLNXJQR-UHFFFAOYSA-N
XLogP9.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.82
LogP ≤ 59.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Tribenzylsilane
CID 284134
Diphenyldi(O-tolyl)silane
CID 3522575
Tris(phenethyl)silane
CID 4625041
Benzyl(diphenyl)silicon
CID 6330282
Tetrabenzylsilane
CID 233883
1,1-Dimethyl-2,3,4,5-tetraphenylsilole
CID 5105497
Phenyltribenzylsilane
CID 233881
Diphenyl(diphenylmethyl)silane
CID 3631522
Phenyltri(O-tolyl)silane
CID 4062260
Benzyltris(3-phenylpropyl)silane
CID 4154799
Diphenyl(3-phenylpropyl)silane
CID 4189462
Benzyl(3-phenylpropyl)silane
CID 4351996

Frequently Asked Questions

What is the IUPAC name of tris(2-cyclohexylethyl)-phenylsilane?
The IUPAC name of tris(2-cyclohexylethyl)-phenylsilane (CID 4146190) is tris(2-cyclohexylethyl)-phenylsilane.
What is the SMILES notation for tris(2-cyclohexylethyl)-phenylsilane?
The canonical SMILES for tris(2-cyclohexylethyl)-phenylsilane is c1ccc([Si](CCC2CCCCC2)(CCC2CCCCC2)CCC2CCCCC2)cc1.
What is the InChIKey of tris(2-cyclohexylethyl)-phenylsilane?
The InChIKey is LSYOLVSDLNXJQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H50Si/c1-5-13-27(14-6-1)21-24-31(30-19-11-4-12-20-30,25-22-28-15-7-2-8-16-28)26-23-29-17-9-3-10-18-29/h4,11-12,19-20,27-29H,1-3,5-10,13-18,21-26H2.
What are the key properties of tris(2-cyclohexylethyl)-phenylsilane?
tris(2-cyclohexylethyl)-phenylsilane has a molecular weight of 438.82 g/mol, XLogP of 9.25, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tris(2-cyclohexylethyl)-phenylsilane is sourced from PubChem (CID 4146190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).