tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane

C15H32OSi — CID 13492542

IUPACtert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane
SMILESCC1CC(O[Si](C)(C)C(C)(C)C)CC(C)(C)C1
InChIInChI=1S/C15H32OSi/c1-12-9-13(11-15(5,6)10-12)16-17(7,8)14(2,3)4/h12-13H,9-11H2,1-8H3
InChIKeyJVSGPFILWCVGCG-UHFFFAOYSA-N
MW256.51 g/mol
LogP5.22
Rot. Bonds2

About tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane

tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane (PubChem CID 13492542) has the molecular formula C15H32OSi and a molecular weight of 256.51 g/mol. Its IUPAC name is tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane
PubChem CID13492542
Molecular FormulaC15H32OSi
Molecular Weight256.51 g/mol
Exact Mass256.22
IUPAC Nametert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane
SMILESCC1CC(O[Si](C)(C)C(C)(C)C)CC(C)(C)C1
InChIInChI=1S/C15H32OSi/c1-12-9-13(11-15(5,6)10-12)16-17(7,8)14(2,3)4/h12-13H,9-11H2,1-8H3
InChIKeyJVSGPFILWCVGCG-UHFFFAOYSA-N
XLogP5.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.51
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane?
The IUPAC name of tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane (CID 13492542) is tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane?
The canonical SMILES for tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane is CC1CC(O[Si](C)(C)C(C)(C)C)CC(C)(C)C1.
What is the InChIKey of tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane?
The InChIKey is JVSGPFILWCVGCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32OSi/c1-12-9-13(11-15(5,6)10-12)16-17(7,8)14(2,3)4/h12-13H,9-11H2,1-8H3.
What are the key properties of tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane?
tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane has a molecular weight of 256.51 g/mol, XLogP of 5.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(3,3,5-trimethylcyclohexyl)oxysilane is sourced from PubChem (CID 13492542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).