cyclohexylmethoxy-ethoxy-diphenylsilane

C21H28O2Si — CID 91724609

IUPACcyclohexylmethoxy-ethoxy-diphenylsilane
SMILESCCO[Si](OCC1CCCCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H28O2Si/c1-2-22-24(20-14-8-4-9-15-20,21-16-10-5-11-17-21)23-18-19-12-6-3-7-13-19/h4-5,8-11,14-17,19H,2-3,6-7,12-13,18H2,1H3
InChIKeyXMRYPNYCFQFCBC-UHFFFAOYSA-N
MW340.54 g/mol
LogP3.88
Rot. Bonds7

About cyclohexylmethoxy-ethoxy-diphenylsilane

cyclohexylmethoxy-ethoxy-diphenylsilane (PubChem CID 91724609) has the molecular formula C21H28O2Si and a molecular weight of 340.54 g/mol. Its IUPAC name is cyclohexylmethoxy-ethoxy-diphenylsilane.

Molecular Properties

Compound Namecyclohexylmethoxy-ethoxy-diphenylsilane
PubChem CID91724609
Molecular FormulaC21H28O2Si
Molecular Weight340.54 g/mol
Exact Mass340.19
IUPAC Namecyclohexylmethoxy-ethoxy-diphenylsilane
SMILESCCO[Si](OCC1CCCCC1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H28O2Si/c1-2-22-24(20-14-8-4-9-15-20,21-16-10-5-11-17-21)23-18-19-12-6-3-7-13-19/h4-5,8-11,14-17,19H,2-3,6-7,12-13,18H2,1H3
InChIKeyXMRYPNYCFQFCBC-UHFFFAOYSA-N
XLogP3.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.54
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 cyclohexylmethoxy-ethoxy-diphenylsilane?
The IUPAC name of cyclohexylmethoxy-ethoxy-diphenylsilane (CID 91724609) is cyclohexylmethoxy-ethoxy-diphenylsilane.
What is the SMILES notation for cyclohexylmethoxy-ethoxy-diphenylsilane?
The canonical SMILES for cyclohexylmethoxy-ethoxy-diphenylsilane is CCO[Si](OCC1CCCCC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of cyclohexylmethoxy-ethoxy-diphenylsilane?
The InChIKey is XMRYPNYCFQFCBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28O2Si/c1-2-22-24(20-14-8-4-9-15-20,21-16-10-5-11-17-21)23-18-19-12-6-3-7-13-19/h4-5,8-11,14-17,19H,2-3,6-7,12-13,18H2,1H3.
What are the key properties of cyclohexylmethoxy-ethoxy-diphenylsilane?
cyclohexylmethoxy-ethoxy-diphenylsilane has a molecular weight of 340.54 g/mol, XLogP of 3.88, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethoxy-ethoxy-diphenylsilane is sourced from PubChem (CID 91724609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).