4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol

C16H32OSi — CID 13280438

IUPAC4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol
SMILESCC(C)(C)C1CCC(O)(C2([Si](C)(C)C)CC2)CC1
InChIInChI=1S/C16H32OSi/c1-14(2,3)13-7-9-15(17,10-8-13)16(11-12-16)18(4,5)6/h13,17H,7-12H2,1-6H3
InChIKeyIQUWMUIVFOZORS-UHFFFAOYSA-N
MW268.52 g/mol
LogP4.83
Rot. Bonds2

About 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol

4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol (PubChem CID 13280438) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol
PubChem CID13280438
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Name4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol
SMILESCC(C)(C)C1CCC(O)(C2([Si](C)(C)C)CC2)CC1
InChIInChI=1S/C16H32OSi/c1-14(2,3)13-7-9-15(17,10-8-13)16(11-12-16)18(4,5)6/h13,17H,7-12H2,1-6H3
InChIKeyIQUWMUIVFOZORS-UHFFFAOYSA-N
XLogP4.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.52
LogP ≤ 54.83
H-Bond Donors ≤ 51
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 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol?
The IUPAC name of 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol (CID 13280438) is 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol.
What is the SMILES notation for 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol?
The canonical SMILES for 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol is CC(C)(C)C1CCC(O)(C2([Si](C)(C)C)CC2)CC1.
What is the InChIKey of 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol?
The InChIKey is IQUWMUIVFOZORS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-14(2,3)13-7-9-15(17,10-8-13)16(11-12-16)18(4,5)6/h13,17H,7-12H2,1-6H3.
What are the key properties of 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol?
4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol has a molecular weight of 268.52 g/mol, XLogP of 4.83, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-1-(1-trimethylsilylcyclopropyl)cyclohexan-1-ol is sourced from PubChem (CID 13280438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).