tert-butyl(tricyclohexyl)silane

C22H42Si — CID 169301443

IUPACtert-butyl(tricyclohexyl)silane
SMILESCC(C)(C)[Si](C1CCCCC1)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C22H42Si/c1-22(2,3)23(19-13-7-4-8-14-19,20-15-9-5-10-16-20)21-17-11-6-12-18-21/h19-21H,4-18H2,1-3H3
InChIKeyOSBVGVHXZIZCRC-UHFFFAOYSA-N
MW334.66 g/mol
LogP8.24
Rot. Bonds3

About tert-butyl(tricyclohexyl)silane

tert-butyl(tricyclohexyl)silane (PubChem CID 169301443) has the molecular formula C22H42Si and a molecular weight of 334.66 g/mol. Its IUPAC name is tert-butyl(tricyclohexyl)silane.

Molecular Properties

Compound Nametert-butyl(tricyclohexyl)silane
PubChem CID169301443
Molecular FormulaC22H42Si
Molecular Weight334.66 g/mol
Exact Mass334.31
IUPAC Nametert-butyl(tricyclohexyl)silane
SMILESCC(C)(C)[Si](C1CCCCC1)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C22H42Si/c1-22(2,3)23(19-13-7-4-8-14-19,20-15-9-5-10-16-20)21-17-11-6-12-18-21/h19-21H,4-18H2,1-3H3
InChIKeyOSBVGVHXZIZCRC-UHFFFAOYSA-N
XLogP8.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.66
LogP ≤ 58.24
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

tert-butyl-cyclopentyl-dimethylsilane
CID 58570155
cobalt;cyclooctane;cyclooctyl(trimethyl)silane
CID 57373058
N-[tert-butyl-cyclopentyl-(ethylamino)silyl]ethanamine
CID 66628624
[amino(dimethyl)silyl]cyclododecane
CID 67884963
bromo-cyclohexyl-dimethylsilane
CID 140692715
tricyclohexyl(trimethylsilyl)silane
CID 139629055
cyclohexyl-(2,2-dimethylpropoxy)-dimethylsilane
CID 589233
N-[cyclohexyl(dimethoxy)silyl]-2-methylpropan-2-amine
CID 68955541
cyclohexyl(trimethoxy)silane
CID 159078583
cyclodecyl-cyclohexyl-dimethoxysilane
CID 139768404
N-[cyclohexyl-cyclopentyl-(dimethylamino)silyl]-N-methylmethanamine
CID 139769704
tert-butylcyclopentadecane
CID 164774831

Frequently Asked Questions

What is the IUPAC name of tert-butyl(tricyclohexyl)silane?
The IUPAC name of tert-butyl(tricyclohexyl)silane (CID 169301443) is tert-butyl(tricyclohexyl)silane.
What is the SMILES notation for tert-butyl(tricyclohexyl)silane?
The canonical SMILES for tert-butyl(tricyclohexyl)silane is CC(C)(C)[Si](C1CCCCC1)(C1CCCCC1)C1CCCCC1.
What is the InChIKey of tert-butyl(tricyclohexyl)silane?
The InChIKey is OSBVGVHXZIZCRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H42Si/c1-22(2,3)23(19-13-7-4-8-14-19,20-15-9-5-10-16-20)21-17-11-6-12-18-21/h19-21H,4-18H2,1-3H3.
What are the key properties of tert-butyl(tricyclohexyl)silane?
tert-butyl(tricyclohexyl)silane has a molecular weight of 334.66 g/mol, XLogP of 8.24, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl(tricyclohexyl)silane is sourced from PubChem (CID 169301443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).