tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane

C15H32O2Si — CID 11219520

IUPACtert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane
SMILESCOC1(OC)CCCCC1C[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32O2Si/c1-14(2,3)18(6,7)12-13-10-8-9-11-15(13,16-4)17-5/h13H,8-12H2,1-7H3
InChIKeyZDAXLSIFZQTOMH-UHFFFAOYSA-N
MW272.50 g/mol
LogP4.67
Rot. Bonds4

About tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane

tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane (PubChem CID 11219520) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane
PubChem CID11219520
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Nametert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane
SMILESCOC1(OC)CCCCC1C[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32O2Si/c1-14(2,3)18(6,7)12-13-10-8-9-11-15(13,16-4)17-5/h13H,8-12H2,1-7H3
InChIKeyZDAXLSIFZQTOMH-UHFFFAOYSA-N
XLogP4.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-Methylcyclohexanone dimethyl acetal
CID 10374699
(7,7-Dimethoxy-1-bicyclo[4.1.0]heptanyl)-trimethylsilane
CID 13359946
[Cyclohexyl(dimethoxy)methyl]silane
CID 5463768
[Cyclohexyl-bis(2-methylpropoxy)methyl]-methylsilane
CID 123471868
[Cyclohexyl(dimethoxy)methyl]-methylsilane
CID 123483525
(2-Cyclohexyl-1,1-dimethoxyethyl)-methylsilane
CID 173326579
(3-Ethyl-1,1-dimethoxyheptyl)-methylsilane
CID 173326640
(2,2-Diethoxy-3-ethylcyclohexyl)-methylsilane
CID 174401826
CID 6328576
CID 6328576
(2-Cyclohexyl-1,1-dimethoxyethyl)-trimethylsilane
CID 21630187

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane?
The IUPAC name of tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane (CID 11219520) is tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane is COC1(OC)CCCCC1C[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane?
The InChIKey is ZDAXLSIFZQTOMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-14(2,3)18(6,7)12-13-10-8-9-11-15(13,16-4)17-5/h13H,8-12H2,1-7H3.
What are the key properties of tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane?
tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane has a molecular weight of 272.50 g/mol, XLogP of 4.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2,2-dimethoxycyclohexyl)methyl]-dimethylsilane is sourced from PubChem (CID 11219520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).