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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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).