triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane

C17H34O4Si2 — CID 15965558

IUPACtriethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane
SMILESCCO[Si](C#CC1(O[Si](C)(C)C)CCCCC1)(OCC)OCC
InChIInChI=1S/C17H34O4Si2/c1-7-18-23(19-8-2,20-9-3)16-15-17(21-22(4,5)6)13-11-10-12-14-17/h7-14H2,1-6H3
InChIKeyHCQTZUFPRMJKON-UHFFFAOYSA-N
MW358.63 g/mol
LogP4.13
Rot. Bonds8

About triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane

triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane (PubChem CID 15965558) has the molecular formula C17H34O4Si2 and a molecular weight of 358.63 g/mol. Its IUPAC name is triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane.

Molecular Properties

Compound Nametriethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane
PubChem CID15965558
Molecular FormulaC17H34O4Si2
Molecular Weight358.63 g/mol
Exact Mass358.20
IUPAC Nametriethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane
SMILESCCO[Si](C#CC1(O[Si](C)(C)C)CCCCC1)(OCC)OCC
InChIInChI=1S/C17H34O4Si2/c1-7-18-23(19-8-2,20-9-3)16-15-17(21-22(4,5)6)13-11-10-12-14-17/h7-14H2,1-6H3
InChIKeyHCQTZUFPRMJKON-UHFFFAOYSA-N
XLogP4.13
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.63
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

Silane, trimethyl[[1-[(trimethylsilyl)ethynyl]cyclohexyl]oxy]-
CID 553519
Dimethyl-trimethylsilyloxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane
CID 68852263
Trimethyl-[1-[2-[methyl-bis(trimethylsilyloxy)silyl]ethynyl]cyclohexyl]oxysilane
CID 68852351
tert-butyl-dimethyl-[(1R,3S)-3-[2-tri(propan-2-yl)silylethynyl]cyclohexyl]oxysilane
CID 134943942
Tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxybut-1-ynyl]cyclohexyl]oxy-dimethylsilane
CID 135008502
4-Triethylsilyloxymethyl-4-trimethylsiloxy-1-octyne
CID 12786191
Trimethyl-(4-methyl-3-triethylsilyloxyoct-1-yn-4-yl)oxysilane
CID 21393000
4-(Tert-butyldimethylsilyloxy)-1-ethynyl-1-trimethylsilanyloxycyclohexane
CID 59293783
(1-Ethynylcyclohexyl)oxy-[[(1-ethynylcyclohexyl)oxy-hydroxy-methylsilyl]methyl]-hydroxy-methylsilane
CID 176819369
(1-Ethynylcyclohexyl)oxy-[[(1-ethynylcyclohexyl)oxy-methoxy-methylsilyl]methyl]-methoxy-methylsilane
CID 176819383
1-[3-Tri(propan-2-yl)silyloxybut-1-ynyl]cyclohexan-1-ol
CID 11645523
2-[1-[Tert-butyl(dimethyl)silyl]oxycyclohexyl]ethynyl-tri(propan-2-yloxy)boranuide
CID 12127907

Frequently Asked Questions

What is the IUPAC name of triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane?
The IUPAC name of triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane (CID 15965558) is triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane.
What is the SMILES notation for triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane?
The canonical SMILES for triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane is CCO[Si](C#CC1(O[Si](C)(C)C)CCCCC1)(OCC)OCC.
What is the InChIKey of triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane?
The InChIKey is HCQTZUFPRMJKON-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O4Si2/c1-7-18-23(19-8-2,20-9-3)16-15-17(21-22(4,5)6)13-11-10-12-14-17/h7-14H2,1-6H3.
What are the key properties of triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane?
triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane has a molecular weight of 358.63 g/mol, XLogP of 4.13, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[2-(1-trimethylsilyloxycyclohexyl)ethynyl]silane is sourced from PubChem (CID 15965558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).