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

C32H58O5Si — CID 141485184

IUPAC2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol
SMILESCC(C1CCC(O)C(OC2CCCCC2)C1)[Si](OC1CCCCC1)(OC1CCCCC1)OC1CCCCC1
InChIInChI=1S/C32H58O5Si/c1-25(26-22-23-31(33)32(24-26)34-27-14-6-2-7-15-27)38(35-28-16-8-3-9-17-28,36-29-18-10-4-11-19-29)37-30-20-12-5-13-21-30/h25-33H,2-24H2,1H3
InChIKeyQZYNYADTUDIAIH-UHFFFAOYSA-N
MW550.90 g/mol
LogP8.24
Rot. Bonds10

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

2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol (PubChem CID 141485184) has the molecular formula C32H58O5Si and a molecular weight of 550.90 g/mol. Its IUPAC name is 2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol
PubChem CID141485184
Molecular FormulaC32H58O5Si
Molecular Weight550.90 g/mol
Exact Mass550.41
IUPAC Name2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol
SMILESCC(C1CCC(O)C(OC2CCCCC2)C1)[Si](OC1CCCCC1)(OC1CCCCC1)OC1CCCCC1
InChIInChI=1S/C32H58O5Si/c1-25(26-22-23-31(33)32(24-26)34-27-14-6-2-7-15-27)38(35-28-16-8-3-9-17-28,36-29-18-10-4-11-19-29)37-30-20-12-5-13-21-30/h25-33H,2-24H2,1H3
InChIKeyQZYNYADTUDIAIH-UHFFFAOYSA-N
XLogP8.24
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500550.90
LogP ≤ 58.24
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-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol?
The IUPAC name of 2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol (CID 141485184) is 2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol.
What is the SMILES notation for 2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol?
The canonical SMILES for 2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol is CC(C1CCC(O)C(OC2CCCCC2)C1)[Si](OC1CCCCC1)(OC1CCCCC1)OC1CCCCC1.
What is the InChIKey of 2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol?
The InChIKey is QZYNYADTUDIAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H58O5Si/c1-25(26-22-23-31(33)32(24-26)34-27-14-6-2-7-15-27)38(35-28-16-8-3-9-17-28,36-29-18-10-4-11-19-29)37-30-20-12-5-13-21-30/h25-33H,2-24H2,1H3.
What are the key properties of 2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol?
2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol has a molecular weight of 550.90 g/mol, XLogP of 8.24, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-4-(1-tricyclohexyloxysilylethyl)cyclohexan-1-ol is sourced from PubChem (CID 141485184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).