tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane

C15H28OSi — CID 101021222

IUPACtert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane
SMILESC=CC1=CCCC(C)(O[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C15H28OSi/c1-8-13-10-9-11-15(5,12-13)16-17(6,7)14(2,3)4/h8,10H,1,9,11-12H2,2-7H3
InChIKeyDPZKQPGXOWQPEI-UHFFFAOYSA-N
MW252.47 g/mol
LogP5.06
Rot. Bonds3

About tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane

tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane (PubChem CID 101021222) has the molecular formula C15H28OSi and a molecular weight of 252.47 g/mol. Its IUPAC name is tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane
PubChem CID101021222
Molecular FormulaC15H28OSi
Molecular Weight252.47 g/mol
Exact Mass252.19
IUPAC Nametert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane
SMILESC=CC1=CCCC(C)(O[Si](C)(C)C(C)(C)C)C1
InChIInChI=1S/C15H28OSi/c1-8-13-10-9-11-15(5,12-13)16-17(6,7)14(2,3)4/h8,10H,1,9,11-12H2,2-7H3
InChIKeyDPZKQPGXOWQPEI-UHFFFAOYSA-N
XLogP5.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.47
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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(1-But-3-enylcyclopent-3-en-1-yl)oxy-tert-butyl-dimethylsilane
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tert-butyl-[[(1R)-3-ethenylcyclohex-3-en-1-yl]methoxy]-dimethylsilane
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(1-Butylcyclohexa-2,4-dien-1-yl)oxy-trimethylsilane
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Dimethyl-(2-methylbutan-2-yloxy)-(4-methylcyclohexa-2,4-dien-1-yl)silane
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Frequently Asked Questions

What is the IUPAC name of tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane?
The IUPAC name of tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane (CID 101021222) is tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane?
The canonical SMILES for tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane is C=CC1=CCCC(C)(O[Si](C)(C)C(C)(C)C)C1.
What is the InChIKey of tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane?
The InChIKey is DPZKQPGXOWQPEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28OSi/c1-8-13-10-9-11-15(5,12-13)16-17(6,7)14(2,3)4/h8,10H,1,9,11-12H2,2-7H3.
What are the key properties of tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane?
tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane has a molecular weight of 252.47 g/mol, XLogP of 5.06, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(3-ethenyl-1-methylcyclohex-3-en-1-yl)oxy-dimethylsilane is sourced from PubChem (CID 101021222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).