1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane

C22H34O4Si2 — CID 54185163

IUPAC1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane
SMILESCCO[Si](OCC)(c1ccccc1)C(C)[Si](OCC)(OCC)c1ccccc1
InChIInChI=1S/C22H34O4Si2/c1-6-23-27(24-7-2,21-16-12-10-13-17-21)20(5)28(25-8-3,26-9-4)22-18-14-11-15-19-22/h10-20H,6-9H2,1-5H3
InChIKeyPEPBHDUGYYGINP-UHFFFAOYSA-N
MW418.68 g/mol
LogP3.76
Rot. Bonds12

About 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane

1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane (PubChem CID 54185163) has the molecular formula C22H34O4Si2 and a molecular weight of 418.68 g/mol. Its IUPAC name is 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane.

Molecular Properties

Compound Name1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane
PubChem CID54185163
Molecular FormulaC22H34O4Si2
Molecular Weight418.68 g/mol
Exact Mass418.20
IUPAC Name1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane
SMILESCCO[Si](OCC)(c1ccccc1)C(C)[Si](OCC)(OCC)c1ccccc1
InChIInChI=1S/C22H34O4Si2/c1-6-23-27(24-7-2,21-16-12-10-13-17-21)20(5)28(25-8-3,26-9-4)22-18-14-11-15-19-22/h10-20H,6-9H2,1-5H3
InChIKeyPEPBHDUGYYGINP-UHFFFAOYSA-N
XLogP3.76
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.68
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

diethoxy-phenyl-(4-phenylbutan-2-yl)silane
CID 153412292
ethane;triethoxy(phenyl)silane
CID 174836592
ethoxy-(ethoxy-methyl-phenylsilyl)-methyl-phenylsilane
CID 19809309
phenyl-tri(propan-2-yloxy)silane;triethoxy(phenyl)silane
CID 159737253
[diethoxy(phenyl)silyl]oxy-diethoxy-phenylsilane
CID 14533277
silane;triethoxy(phenyl)silane;hydrofluoride
CID 174494492
diethoxy-phenyl-sulfanylsilane
CID 141237181
ethoxy-iodo-methyl-phenylsilane
CID 154486985
fluorosilane;triethoxy(phenyl)silane
CID 174494490
ethoxy-ethyl-phenyl-propylsilane
CID 68659738
boric acid;triethoxy(phenyl)silane
CID 174800585
diethoxy-(4-methylphenyl)-phenylsilane
CID 68659610

Frequently Asked Questions

What is the IUPAC name of 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane?
The IUPAC name of 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane (CID 54185163) is 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane.
What is the SMILES notation for 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane?
The canonical SMILES for 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane is CCO[Si](OCC)(c1ccccc1)C(C)[Si](OCC)(OCC)c1ccccc1.
What is the InChIKey of 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane?
The InChIKey is PEPBHDUGYYGINP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34O4Si2/c1-6-23-27(24-7-2,21-16-12-10-13-17-21)20(5)28(25-8-3,26-9-4)22-18-14-11-15-19-22/h10-20H,6-9H2,1-5H3.
What are the key properties of 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane?
1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane has a molecular weight of 418.68 g/mol, XLogP of 3.76, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane is sourced from PubChem (CID 54185163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).