2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol

C17H34O5Si — CID 140807900

IUPAC2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol
SMILESCO[Si](CCC1CCC(O)C(OC2CCCCC2)C1)(OC)OC
InChIInChI=1S/C17H34O5Si/c1-19-23(20-2,21-3)12-11-14-9-10-16(18)17(13-14)22-15-7-5-4-6-8-15/h14-18H,4-13H2,1-3H3
InChIKeyGSBSWFUXIQFSCQ-UHFFFAOYSA-N
MW346.54 g/mol
LogP3.13
Rot. Bonds8

About 2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol

2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol (PubChem CID 140807900) has the molecular formula C17H34O5Si and a molecular weight of 346.54 g/mol. Its IUPAC name is 2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol
PubChem CID140807900
Molecular FormulaC17H34O5Si
Molecular Weight346.54 g/mol
Exact Mass346.22
IUPAC Name2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol
SMILESCO[Si](CCC1CCC(O)C(OC2CCCCC2)C1)(OC)OC
InChIInChI=1S/C17H34O5Si/c1-19-23(20-2,21-3)12-11-14-9-10-16(18)17(13-14)22-15-7-5-4-6-8-15/h14-18H,4-13H2,1-3H3
InChIKeyGSBSWFUXIQFSCQ-UHFFFAOYSA-N
XLogP3.13
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.54
LogP ≤ 53.13
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-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol?
The IUPAC name of 2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol (CID 140807900) is 2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol.
What is the SMILES notation for 2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol?
The canonical SMILES for 2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol is CO[Si](CCC1CCC(O)C(OC2CCCCC2)C1)(OC)OC.
What is the InChIKey of 2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol?
The InChIKey is GSBSWFUXIQFSCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O5Si/c1-19-23(20-2,21-3)12-11-14-9-10-16(18)17(13-14)22-15-7-5-4-6-8-15/h14-18H,4-13H2,1-3H3.
What are the key properties of 2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol?
2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol has a molecular weight of 346.54 g/mol, XLogP of 3.13, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-4-(2-trimethoxysilylethyl)cyclohexan-1-ol is sourced from PubChem (CID 140807900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).