tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane

C17H34OSi — CID 139775020

IUPACtert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane
SMILESC=C1CCCC(C)(C)[C@H]1CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H34OSi/c1-14-10-9-12-17(5,6)15(14)11-13-18-19(7,8)16(2,3)4/h15H,1,9-13H2,2-8H3/t15-/m0/s1
InChIKeyZJDMNKGOTXKZEH-HNNXBMFYSA-N
MW282.54 g/mol
LogP5.78
Rot. Bonds4

About tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane

tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane (PubChem CID 139775020) has the molecular formula C17H34OSi and a molecular weight of 282.54 g/mol. Its IUPAC name is tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane
PubChem CID139775020
Molecular FormulaC17H34OSi
Molecular Weight282.54 g/mol
Exact Mass282.24
IUPAC Nametert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane
SMILESC=C1CCCC(C)(C)[C@H]1CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H34OSi/c1-14-10-9-12-17(5,6)15(14)11-13-18-19(7,8)16(2,3)4/h15H,1,9-13H2,2-8H3/t15-/m0/s1
InChIKeyZJDMNKGOTXKZEH-HNNXBMFYSA-N
XLogP5.78
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.54
LogP ≤ 55.78
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

tert-butyl-dimethyl-[2-[(1S,3R,5S)-1-methyl-2-methylidene-5-propan-2-yl-3-trimethylsilylcyclopentyl]ethoxy]silane
CID 11406012
Tert-butyl-[1-[1-[tert-butyl(dimethyl)silyl]ethenoxy]-4-(2,2-dimethyl-6-methylidenecyclohexyl)butoxy]-dimethylsilane
CID 13353557
Tert-butyl-[2-(2,2-dimethyl-6-methylidenecyclohexyl)ethoxy]-dimethylsilane
CID 14563308
(1-Cyclohexyl-2-methylidenedodecoxy)-trimethylsilane
CID 44518239
Tert-butyl-dimethyl-(9-methyl-9-prop-2-enyldodec-11-enoxy)silane
CID 46185276
(3a-methyl-4-methylidene-2,3,5,6,7,7a-hexahydro-1H-inden-1-yl)oxy-tert-butyl-dimethylsilane
CID 75219742
[(1S)-1-cyclohexyl-2-methylideneoctoxy]-triethylsilane
CID 135000775
tert-butyl-dimethyl-[(5R)-5-methyl-5-[(E)-2-[(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]ethenyl]non-8-enoxy]silane
CID 139263604
[(6R)-6-cyclohexyloct-7-enoxy]-tri(propan-2-yl)silane
CID 176426908
Silane, (1,1-dimethylethyl)dimethyl((2-(2-methyl-2-propenyl)cyclohexyl)oxy)-, trans-
CID 182723
t-Butyl-[2-(2,2-dimethyl-6-methylene-cyclohexylmethyl)-cyclopropoxy]-dimethyl-silane
CID 552481
1-(t-Butyldimethylsilyl)-4-(2,2-dimethyl-6-methylene-cyclohexyl)-butan-1-ol
CID 554440

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane (CID 139775020) is tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane is C=C1CCCC(C)(C)[C@H]1CCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane?
The InChIKey is ZJDMNKGOTXKZEH-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H34OSi/c1-14-10-9-12-17(5,6)15(14)11-13-18-19(7,8)16(2,3)4/h15H,1,9-13H2,2-8H3/t15-/m0/s1.
What are the key properties of tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane?
tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane has a molecular weight of 282.54 g/mol, XLogP of 5.78, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-[(1R)-2,2-dimethyl-6-methylidenecyclohexyl]ethoxy]-dimethylsilane is sourced from PubChem (CID 139775020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).