tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane

C16H30OSi — CID 22150485

IUPACtert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane
SMILESC#CC(C)(O[Si](C)(C)C(C)(C)C)C1CCCCC1
InChIInChI=1S/C16H30OSi/c1-8-16(5,14-12-10-9-11-13-14)17-18(6,7)15(2,3)4/h1,14H,9-13H2,2-7H3
InChIKeyVQIGMWJGEUVIMN-UHFFFAOYSA-N
MW266.50 g/mol
LogP4.98
Rot. Bonds3

About tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane

tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane (PubChem CID 22150485) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane
PubChem CID22150485
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Nametert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane
SMILESC#CC(C)(O[Si](C)(C)C(C)(C)C)C1CCCCC1
InChIInChI=1S/C16H30OSi/c1-8-16(5,14-12-10-9-11-13-14)17-18(6,7)15(2,3)4/h1,14H,9-13H2,2-7H3
InChIKeyVQIGMWJGEUVIMN-UHFFFAOYSA-N
XLogP4.98
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.50
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Triethyl[(1-ethynylcyclohexyl)oxy]silane
CID 12489717
2-Cyclohexyl-4-tri(propan-2-yl)silylbut-3-yn-2-ol
CID 164669382
3-Tert-butyldimethylsilyloxy-3-cyclohexylprop-1-yne
CID 5461810
tert-Butyldimethyl(((trans)-4-(prop-2-yn-1-yl)cyclohexyl)methoxy)silane
CID 10515931
(3S)-3-(tert-Butyldimethylsiloxy)-3-cyclohexylprop-1-yne
CID 11983898
Tert-butyl-(1-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane
CID 19042200
4-Methyl-4-trimethylsilyloxy-1-decyne
CID 20442096
1-Propargyl-1-trimethylsilyloxycyclohexane
CID 20565023
4-Cyclopropyldec-1-yn-4-yloxy(trimethyl)silane
CID 53675774
tert-butyl-[(2S)-2-cyclohexylbut-3-yn-2-yl]oxy-dimethylsilane
CID 54405400
tert-butyl-[(2S)-1-cyclohexylbut-3-yn-2-yl]oxy-dimethylsilane
CID 54533356
2-Ethynyl-1-(2-trimethylsilylethynyl)cyclododecan-1-ol
CID 86053089

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane?
The IUPAC name of tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane (CID 22150485) is tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane is C#CC(C)(O[Si](C)(C)C(C)(C)C)C1CCCCC1.
What is the InChIKey of tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane?
The InChIKey is VQIGMWJGEUVIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30OSi/c1-8-16(5,14-12-10-9-11-13-14)17-18(6,7)15(2,3)4/h1,14H,9-13H2,2-7H3.
What are the key properties of tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane?
tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane has a molecular weight of 266.50 g/mol, XLogP of 4.98, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2-cyclohexylbut-3-yn-2-yloxy)-dimethylsilane is sourced from PubChem (CID 22150485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).