tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane

C13H26OSi — CID 11322116

IUPACtert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane
SMILESCC1=C(O[Si](C)(C)C(C)(C)C)CCCC1
InChIInChI=1S/C13H26OSi/c1-11-9-7-8-10-12(11)14-15(5,6)13(2,3)4/h7-10H2,1-6H3
InChIKeyIZGABXJNURCQOP-UHFFFAOYSA-N
MW226.44 g/mol
LogP4.86
Rot. Bonds2

About tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane

tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane (PubChem CID 11322116) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane
PubChem CID11322116
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Nametert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane
SMILESCC1=C(O[Si](C)(C)C(C)(C)C)CCCC1
InChIInChI=1S/C13H26OSi/c1-11-9-7-8-10-12(11)14-15(5,6)13(2,3)4/h7-10H2,1-6H3
InChIKeyIZGABXJNURCQOP-UHFFFAOYSA-N
XLogP4.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.86
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-(2-methylcyclohexen-1-yl)oxysilane?
The IUPAC name of tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane (CID 11322116) is tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane?
The canonical SMILES for tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane is CC1=C(O[Si](C)(C)C(C)(C)C)CCCC1.
What is the InChIKey of tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane?
The InChIKey is IZGABXJNURCQOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-11-9-7-8-10-12(11)14-15(5,6)13(2,3)4/h7-10H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane?
tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane has a molecular weight of 226.44 g/mol, XLogP of 4.86, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2-methylcyclohexen-1-yl)oxysilane is sourced from PubChem (CID 11322116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).