trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane

C16H34OSi2 — CID 135067883

IUPACtrimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane
SMILESCC(/C=C/[Si](C)(C)C)[C@@H]1CCCC[C@H]1O[Si](C)(C)C
InChIInChI=1S/C16H34OSi2/c1-14(12-13-18(2,3)4)15-10-8-9-11-16(15)17-19(5,6)7/h12-16H,8-11H2,1-7H3/b13-12+/t14?,15-,16+/m0/s1
InChIKeyJGXLHBSHABNWQW-PDZMRMAESA-N
MW298.62 g/mol
LogP5.47
Rot. Bonds5

About trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane

trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane (PubChem CID 135067883) has the molecular formula C16H34OSi2 and a molecular weight of 298.62 g/mol. Its IUPAC name is trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane
PubChem CID135067883
Molecular FormulaC16H34OSi2
Molecular Weight298.62 g/mol
Exact Mass298.21
IUPAC Nametrimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane
SMILESCC(/C=C/[Si](C)(C)C)[C@@H]1CCCC[C@H]1O[Si](C)(C)C
InChIInChI=1S/C16H34OSi2/c1-14(12-13-18(2,3)4)15-10-8-9-11-16(15)17-19(5,6)7/h12-16H,8-11H2,1-7H3/b13-12+/t14?,15-,16+/m0/s1
InChIKeyJGXLHBSHABNWQW-PDZMRMAESA-N
XLogP5.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.62
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane with MolForge

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Related Compounds

Tert-butyl-(1-cyclohexylprop-2-enoxy)-dimethylsilane
CID 11253834
Silane, [(1-cyclohexyl-2-propenyl)oxy]trimethyl-
CID 10910863
tert-butyl-dimethyl-[(1S,2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexyl]oxysilane
CID 11021914
(1-Cyclohexyl-2-methylidenedodecoxy)-trimethylsilane
CID 44518239
tert-butyl-[(E,1S,2R)-1-cyclohexyl-2-methyltridec-5-en-3-ynoxy]-dimethylsilane
CID 101168210
trans-(1R,2R)-2-[(E)-1,3-bis(trimethylsilyl)prop-2-enyl]cyclohexan-1-ol
CID 101593845
[(E)-3-cyclohexyl-3-trimethylsilyloxyprop-1-enyl]-tri(propan-2-yl)silane
CID 134883124
tert-butyl-[(3R,4S)-4-ethenyl-2-methyloctan-3-yl]oxy-dimethylsilane
CID 134980552
[(1S)-1-cyclohexyl-2-methylideneoctoxy]-triethylsilane
CID 135000775
trans-(1R,2R)-2-[(E)-1,3-bis(trimethylsilyl)prop-2-enyl]cyclohexan-1-olate
CID 135010036
trimethyl-[(E)-3-[(1S,2R)-2-trimethylsilyloxycyclohexyl]prop-2-enyl]silane
CID 135066666
trimethyl-[(E)-3-[(1S,2R)-2-trimethylsilyloxycyclohexyl]prop-1-enyl]silane
CID 135066667

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane?
The IUPAC name of trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane (CID 135067883) is trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane.
What is the SMILES notation for trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane?
The canonical SMILES for trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane is CC(/C=C/[Si](C)(C)C)[C@@H]1CCCC[C@H]1O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane?
The InChIKey is JGXLHBSHABNWQW-PDZMRMAESA-N. The full InChI is InChI=1S/C16H34OSi2/c1-14(12-13-18(2,3)4)15-10-8-9-11-16(15)17-19(5,6)7/h12-16H,8-11H2,1-7H3/b13-12+/t14?,15-,16+/m0/s1.
What are the key properties of trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane?
trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane has a molecular weight of 298.62 g/mol, XLogP of 5.47, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(1R,2S)-2-[(E)-4-trimethylsilylbut-3-en-2-yl]cyclohexyl]oxysilane is sourced from PubChem (CID 135067883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).