trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane

C16H30OSi2 — CID 14635032

IUPACtrimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane
SMILESC[Si](C)(C)C#CCCC1C=C(O[Si](C)(C)C)CCC1
InChIInChI=1S/C16H30OSi2/c1-18(2,3)13-8-7-10-15-11-9-12-16(14-15)17-19(4,5)6/h14-15H,7,9-12H2,1-6H3
InChIKeyGJCCBDYRMJAJSQ-UHFFFAOYSA-N
MW294.59 g/mol
LogP5.18
Rot. Bonds4

About trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane

trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane (PubChem CID 14635032) has the molecular formula C16H30OSi2 and a molecular weight of 294.59 g/mol. Its IUPAC name is trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane
PubChem CID14635032
Molecular FormulaC16H30OSi2
Molecular Weight294.59 g/mol
Exact Mass294.18
IUPAC Nametrimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane
SMILESC[Si](C)(C)C#CCCC1C=C(O[Si](C)(C)C)CCC1
InChIInChI=1S/C16H30OSi2/c1-18(2,3)13-8-7-10-15-11-9-12-16(14-15)17-19(4,5)6/h14-15H,7,9-12H2,1-6H3
InChIKeyGJCCBDYRMJAJSQ-UHFFFAOYSA-N
XLogP5.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.59
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(3-Ethylcyclohexen-1-yl)oxy-trimethylsilane
CID 597987
Trimethyl-[3-(3-methylbut-3-enyl)cyclohexen-1-yl]oxysilane
CID 10490148
Trimethyl-[3-(4-methylpent-3-enyl)cyclohexen-1-yl]oxysilane
CID 10658496
(3-But-3-enylcyclohexen-1-yl)oxy-trimethylsilane
CID 11042390
[(3S)-3-ethylcyclohexen-1-yl]oxy-trimethylsilane
CID 11229389
[(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-(3-but-3-yn-2-ylcyclohexen-1-yl)oxy-dimethylsilane
CID 12079486
Trimethyl-[2-methyl-3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane
CID 14635035
Tert-butyl-dimethyl-(3-prop-2-enylcyclohexen-1-yl)oxysilane
CID 15691232
tert-butyl-[(3S,5R)-3-(3-iodoprop-2-ynyl)-5-methyl-2-prop-2-enylcyclohexen-1-yl]oxy-dimethylsilane
CID 23658987
[(3S,6S)-3-butyl-2-methyl-6-triethylsilylcyclohexen-1-yl]oxy-trimethylsilane
CID 134939335
triethyl-[(3S)-3-[5-tri(propan-2-yl)silylpent-4-ynyl]cyclohexen-1-yl]oxysilane
CID 134956682

Frequently Asked Questions

What is the IUPAC name of trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane?
The IUPAC name of trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane (CID 14635032) is trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane.
What is the SMILES notation for trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane?
The canonical SMILES for trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane is C[Si](C)(C)C#CCCC1C=C(O[Si](C)(C)C)CCC1.
What is the InChIKey of trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane?
The InChIKey is GJCCBDYRMJAJSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30OSi2/c1-18(2,3)13-8-7-10-15-11-9-12-16(14-15)17-19(4,5)6/h14-15H,7,9-12H2,1-6H3.
What are the key properties of trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane?
trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane has a molecular weight of 294.59 g/mol, XLogP of 5.18, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-(4-trimethylsilylbut-3-ynyl)cyclohexen-1-yl]oxysilane is sourced from PubChem (CID 14635032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).