2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol

C15H32O5Si — CID 141485190

IUPAC2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol
SMILESCCO[Si](CCC1CCC(O)C(OC)C1)(OCC)OCC
InChIInChI=1S/C15H32O5Si/c1-5-18-21(19-6-2,20-7-3)11-10-13-8-9-14(16)15(12-13)17-4/h13-16H,5-12H2,1-4H3
InChIKeyZWJBJBUSEJLKHG-UHFFFAOYSA-N
MW320.50 g/mol
LogP2.60
Rot. Bonds10

About 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol

2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol (PubChem CID 141485190) has the molecular formula C15H32O5Si and a molecular weight of 320.50 g/mol. Its IUPAC name is 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol
PubChem CID141485190
Molecular FormulaC15H32O5Si
Molecular Weight320.50 g/mol
Exact Mass320.20
IUPAC Name2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol
SMILESCCO[Si](CCC1CCC(O)C(OC)C1)(OCC)OCC
InChIInChI=1S/C15H32O5Si/c1-5-18-21(19-6-2,20-7-3)11-10-13-8-9-14(16)15(12-13)17-4/h13-16H,5-12H2,1-4H3
InChIKeyZWJBJBUSEJLKHG-UHFFFAOYSA-N
XLogP2.60
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.50
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol?
The IUPAC name of 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol (CID 141485190) is 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol.
What is the SMILES notation for 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol?
The canonical SMILES for 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol is CCO[Si](CCC1CCC(O)C(OC)C1)(OCC)OCC.
What is the InChIKey of 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol?
The InChIKey is ZWJBJBUSEJLKHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O5Si/c1-5-18-21(19-6-2,20-7-3)11-10-13-8-9-14(16)15(12-13)17-4/h13-16H,5-12H2,1-4H3.
What are the key properties of 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol?
2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol has a molecular weight of 320.50 g/mol, XLogP of 2.60, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(2-triethoxysilylethyl)cyclohexan-1-ol is sourced from PubChem (CID 141485190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).