[cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane

C22H46O4Si2 — CID 123752911

IUPAC[cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane
SMILESCCO[SiH](OCC)C(C1CCCCC1)[Si](CC1CCCCC1)(OCC)OCC
InChIInChI=1S/C22H46O4Si2/c1-5-23-27(24-6-2)22(21-17-13-10-14-18-21)28(25-7-3,26-8-4)19-20-15-11-9-12-16-20/h20-22,27H,5-19H2,1-4H3
InChIKeyGQZOUYJVZHBQRU-UHFFFAOYSA-N
MW430.78 g/mol
LogP5.87
Rot. Bonds13

About [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane

[cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane (PubChem CID 123752911) has the molecular formula C22H46O4Si2 and a molecular weight of 430.78 g/mol. Its IUPAC name is [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane.

Molecular Properties

Compound Name[cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane
PubChem CID123752911
Molecular FormulaC22H46O4Si2
Molecular Weight430.78 g/mol
Exact Mass430.29
IUPAC Name[cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane
SMILESCCO[SiH](OCC)C(C1CCCCC1)[Si](CC1CCCCC1)(OCC)OCC
InChIInChI=1S/C22H46O4Si2/c1-5-23-27(24-6-2)22(21-17-13-10-14-18-21)28(25-7-3,26-8-4)19-20-15-11-9-12-16-20/h20-22,27H,5-19H2,1-4H3
InChIKeyGQZOUYJVZHBQRU-UHFFFAOYSA-N
XLogP5.87
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.78
LogP ≤ 55.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane?
The IUPAC name of [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane (CID 123752911) is [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane.
What is the SMILES notation for [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane?
The canonical SMILES for [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane is CCO[SiH](OCC)C(C1CCCCC1)[Si](CC1CCCCC1)(OCC)OCC.
What is the InChIKey of [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane?
The InChIKey is GQZOUYJVZHBQRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H46O4Si2/c1-5-23-27(24-6-2)22(21-17-13-10-14-18-21)28(25-7-3,26-8-4)19-20-15-11-9-12-16-20/h20-22,27H,5-19H2,1-4H3.
What are the key properties of [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane?
[cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane has a molecular weight of 430.78 g/mol, XLogP of 5.87, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohexyl(diethoxysilyl)methyl]-(cyclohexylmethyl)-diethoxysilane is sourced from PubChem (CID 123752911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).