tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane

C16H34OSi — CID 11021977

IUPACtert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane
SMILESCC(C)(C)C1CCC(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C16H34OSi/c1-15(2,3)13-9-11-14(12-10-13)17-18(7,8)16(4,5)6/h13-14H,9-12H2,1-8H3
InChIKeyIAIGDQFCJXZEQF-UHFFFAOYSA-N
MW270.53 g/mol
LogP5.61
Rot. Bonds2

About tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane

tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane (PubChem CID 11021977) has the molecular formula C16H34OSi and a molecular weight of 270.53 g/mol. Its IUPAC name is tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane
PubChem CID11021977
Molecular FormulaC16H34OSi
Molecular Weight270.53 g/mol
Exact Mass270.24
IUPAC Nametert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane
SMILESCC(C)(C)C1CCC(O[Si](C)(C)C(C)(C)C)CC1
InChIInChI=1S/C16H34OSi/c1-15(2,3)13-9-11-14(12-10-13)17-18(7,8)16(4,5)6/h13-14H,9-12H2,1-8H3
InChIKeyIAIGDQFCJXZEQF-UHFFFAOYSA-N
XLogP5.61
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.53
LogP ≤ 55.61
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-(4-tert-butylcyclohexyl)oxy-dimethylsilane?
The IUPAC name of tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane (CID 11021977) is tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane?
The canonical SMILES for tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane is CC(C)(C)C1CCC(O[Si](C)(C)C(C)(C)C)CC1.
What is the InChIKey of tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane?
The InChIKey is IAIGDQFCJXZEQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34OSi/c1-15(2,3)13-9-11-14(12-10-13)17-18(7,8)16(4,5)6/h13-14H,9-12H2,1-8H3.
What are the key properties of tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane?
tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane has a molecular weight of 270.53 g/mol, XLogP of 5.61, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane is sourced from PubChem (CID 11021977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).