(4-tert-butylcyclohexyl)-trimethylsilane

C13H28Si — CID 13280424

IUPAC(4-tert-butylcyclohexyl)-trimethylsilane
SMILESCC(C)(C)C1CCC([Si](C)(C)C)CC1
InChIInChI=1S/C13H28Si/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h11-12H,7-10H2,1-6H3
InChIKeyBPASXJMQTJHTQJ-UHFFFAOYSA-N
MW212.45 g/mol
LogP4.93
Rot. Bonds1

About (4-tert-butylcyclohexyl)-trimethylsilane

(4-tert-butylcyclohexyl)-trimethylsilane (PubChem CID 13280424) has the molecular formula C13H28Si and a molecular weight of 212.45 g/mol. Its IUPAC name is (4-tert-butylcyclohexyl)-trimethylsilane.

Molecular Properties

Compound Name(4-tert-butylcyclohexyl)-trimethylsilane
PubChem CID13280424
Molecular FormulaC13H28Si
Molecular Weight212.45 g/mol
Exact Mass212.20
IUPAC Name(4-tert-butylcyclohexyl)-trimethylsilane
SMILESCC(C)(C)C1CCC([Si](C)(C)C)CC1
InChIInChI=1S/C13H28Si/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h11-12H,7-10H2,1-6H3
InChIKeyBPASXJMQTJHTQJ-UHFFFAOYSA-N
XLogP4.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.45
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (4-tert-butylcyclohexyl)-trimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4-tert-butylcyclohexyl)-trimethylsilane?
The IUPAC name of (4-tert-butylcyclohexyl)-trimethylsilane (CID 13280424) is (4-tert-butylcyclohexyl)-trimethylsilane.
What is the SMILES notation for (4-tert-butylcyclohexyl)-trimethylsilane?
The canonical SMILES for (4-tert-butylcyclohexyl)-trimethylsilane is CC(C)(C)C1CCC([Si](C)(C)C)CC1.
What is the InChIKey of (4-tert-butylcyclohexyl)-trimethylsilane?
The InChIKey is BPASXJMQTJHTQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28Si/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h11-12H,7-10H2,1-6H3.
What are the key properties of (4-tert-butylcyclohexyl)-trimethylsilane?
(4-tert-butylcyclohexyl)-trimethylsilane has a molecular weight of 212.45 g/mol, XLogP of 4.93, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-tert-butylcyclohexyl)-trimethylsilane is sourced from PubChem (CID 13280424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).