tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane

C13H26OSi — CID 78068825

IUPACtert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC1C=CCCC1
InChIInChI=1S/C13H26OSi/c1-13(2,3)15(4,5)14-11-12-9-7-6-8-10-12/h7,9,12H,6,8,10-11H2,1-5H3
InChIKeyNVNCWGDWGDKHAR-UHFFFAOYSA-N
MW226.44 g/mol
LogP4.36
Rot. Bonds3

About tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane

tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane (PubChem CID 78068825) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane
PubChem CID78068825
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Nametert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCC1C=CCCC1
InChIInChI=1S/C13H26OSi/c1-13(2,3)15(4,5)14-11-12-9-7-6-8-10-12/h7,9,12H,6,8,10-11H2,1-5H3
InChIKeyNVNCWGDWGDKHAR-UHFFFAOYSA-N
XLogP4.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[2-(3-Cyclohexenyl)ethyl]triethoxysilane
CID 11300254
Silane, [(3,7-dimethyl-6-octenyl)oxy]trimethyl-
CID 557338
Trimethyl[(6-methylcyclohex-1-en-1-yl)oxy]silane
CID 11063095
tert-butyl-dimethyl-[(1S,6S)-6-prop-2-enylcyclohex-3-en-1-yl]oxysilane
CID 11543369
Tert-butyl-(1-cyclopent-3-en-1-ylbut-3-enoxy)-dimethylsilane
CID 11666003
(S)-tert-butyl((3,7-dimethyloct-6-en-1-yl)oxy)dimethylsilane
CID 22882877
tert-butyl-dimethyl-[(1S,6R)-6-prop-2-enylcyclohex-3-en-1-yl]oxysilane
CID 134979966
beta-Citronellol, TBDMS derivative
CID 11043851
Silane, dimethyl(non-3-enyloxy)isohexyloxy-
CID 91698241
1,2,3,6-Tetrahydrobenzylalcohol, tert-butyldimethylsilyl ether
CID 11229886
3,7-Dimethyloct-6-enoxy(triethyl)silane
CID 72751260
(3aR,6S,7aR)-1,1,6-trimethyl-3a,6,7,7a-tetrahydro-3H-2,1-benzoxasilole
CID 10261766

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane (CID 78068825) is tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane is CC(C)(C)[Si](C)(C)OCC1C=CCCC1.
What is the InChIKey of tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane?
The InChIKey is NVNCWGDWGDKHAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-13(2,3)15(4,5)14-11-12-9-7-6-8-10-12/h7,9,12H,6,8,10-11H2,1-5H3.
What are the key properties of tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane?
tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane has a molecular weight of 226.44 g/mol, XLogP of 4.36, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(cyclohex-2-en-1-ylmethoxy)-dimethylsilane is sourced from PubChem (CID 78068825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).