tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane

C17H34OSi — CID 162400600

IUPACtert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane
SMILESCC(C)(CC[C@@H]1C=CCCC1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H34OSi/c1-16(2,3)19(6,7)18-17(4,5)14-13-15-11-9-8-10-12-15/h9,11,15H,8,10,12-14H2,1-7H3/t15-/m1/s1
InChIKeyPEICHMCWIISIOC-OAHLLOKOSA-N
MW282.54 g/mol
LogP5.92
Rot. Bonds5

About tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane

tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane (PubChem CID 162400600) has the molecular formula C17H34OSi and a molecular weight of 282.54 g/mol. Its IUPAC name is tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane
PubChem CID162400600
Molecular FormulaC17H34OSi
Molecular Weight282.54 g/mol
Exact Mass282.24
IUPAC Nametert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane
SMILESCC(C)(CC[C@@H]1C=CCCC1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H34OSi/c1-16(2,3)19(6,7)18-17(4,5)14-13-15-11-9-8-10-12-15/h9,11,15H,8,10,12-14H2,1-7H3/t15-/m1/s1
InChIKeyPEICHMCWIISIOC-OAHLLOKOSA-N
XLogP5.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.54
LogP ≤ 55.92
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

(3-But-3-enylcyclohexen-1-yl)oxy-trimethylsilane
CID 11042390
alpha-Bisabolol, TMS derivative
CID 14486055
Trimethyl-(3-methylcyclopentadecen-1-yl)oxysilane
CID 69502889
[(3S,5R)-3-buta-2,3-dien-2-yl-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl]oxy-tert-butyl-dimethylsilane
CID 11244074
Tert-butyl-(8-cyclohex-3-en-1-yloctoxy)-dimethylsilane
CID 11313354
trimethyl-[(3R,4R)-3-methyl-3-[2-[(1S)-1-methylcyclohex-2-en-1-yl]ethyl]-4-propan-2-ylcyclopenten-1-yl]oxysilane
CID 11984323
triethyl-[(9E)-5-prop-1-ynylundeca-1,9-dien-5-yl]oxysilane
CID 14936192
Tert-butyl-dimethyl-(3-prop-2-enylcyclohexen-1-yl)oxysilane
CID 15691232
Tert-butyl-dimethyl-(3-prop-2-enylcyclohepten-1-yl)oxysilane
CID 101155880
tert-butyl-[(E,1S,2R)-1-cyclohexyl-2-methyltridec-5-en-3-ynoxy]-dimethylsilane
CID 101168210
(3E)-4-butyl-2,2-ditert-butyl-5,5-diethyl-3-pentylideneoxasilolane
CID 101474220
triethyl-[(9Z)-6-prop-1-ynyldodeca-1,9-dien-6-yl]oxysilane
CID 101673816

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane (CID 162400600) is tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane is CC(C)(CC[C@@H]1C=CCCC1)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane?
The InChIKey is PEICHMCWIISIOC-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H34OSi/c1-16(2,3)19(6,7)18-17(4,5)14-13-15-11-9-8-10-12-15/h9,11,15H,8,10,12-14H2,1-7H3/t15-/m1/s1.
What are the key properties of tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane?
tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane has a molecular weight of 282.54 g/mol, XLogP of 5.92, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[4-[(1R)-cyclohex-2-en-1-yl]-2-methylbutan-2-yl]oxy-dimethylsilane is sourced from PubChem (CID 162400600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).