ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane

C29H32O4Si2 — CID 66773814

IUPACethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane
SMILESCC[Si](C[Si](CC)(Oc1ccccc1)Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C29H32O4Si2/c1-3-34(30-26-17-9-5-10-18-26,31-27-19-11-6-12-20-27)25-35(4-2,32-28-21-13-7-14-22-28)33-29-23-15-8-16-24-29/h5-24H,3-4,25H2,1-2H3
InChIKeyXEDLDWYHXBBUMK-UHFFFAOYSA-N
MW500.74 g/mol
LogP7.77
Rot. Bonds12

About ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane

ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane (PubChem CID 66773814) has the molecular formula C29H32O4Si2 and a molecular weight of 500.74 g/mol. Its IUPAC name is ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane.

Molecular Properties

Compound Nameethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane
PubChem CID66773814
Molecular FormulaC29H32O4Si2
Molecular Weight500.74 g/mol
Exact Mass500.18
IUPAC Nameethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane
SMILESCC[Si](C[Si](CC)(Oc1ccccc1)Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/C29H32O4Si2/c1-3-34(30-26-17-9-5-10-18-26,31-27-19-11-6-12-20-27)25-35(4-2,32-28-21-13-7-14-22-28)33-29-23-15-8-16-24-29/h5-24H,3-4,25H2,1-2H3
InChIKeyXEDLDWYHXBBUMK-UHFFFAOYSA-N
XLogP7.77
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500500.74
LogP ≤ 57.77
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

ethyl-diphenoxy-propylsilane
CID 140623858
ethoxy-diethyl-phenoxysilane
CID 15146062
4-[diethyl(phenoxy)silyl]butyl-diethyl-phenoxysilane
CID 66773415
phenoxy-diphenyl-propylsilane
CID 66773867
1-triphenoxysilylpropane-1-thiol
CID 22019778
butyl-diiodo-phenoxysilane
CID 140745005
anisole;ethyl(trimethoxy)silane
CID 174632605
triethyl(1-phenoxyprop-1-enyl)silane
CID 23265307
(4-benzylphenoxy)-triethylsilane
CID 102358049
benzyl-methyl-diphenoxysilane
CID 140892779
dihydroxy(diphenoxy)silane
CID 21291686
ethane;phenoxybenzene;propane
CID 90923491

Frequently Asked Questions

What is the IUPAC name of ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane?
The IUPAC name of ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane (CID 66773814) is ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane.
What is the SMILES notation for ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane?
The canonical SMILES for ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane is CC[Si](C[Si](CC)(Oc1ccccc1)Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1.
What is the InChIKey of ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane?
The InChIKey is XEDLDWYHXBBUMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32O4Si2/c1-3-34(30-26-17-9-5-10-18-26,31-27-19-11-6-12-20-27)25-35(4-2,32-28-21-13-7-14-22-28)33-29-23-15-8-16-24-29/h5-24H,3-4,25H2,1-2H3.
What are the key properties of ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane?
ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane has a molecular weight of 500.74 g/mol, XLogP of 7.77, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-[[ethyl(diphenoxy)silyl]methyl]-diphenoxysilane is sourced from PubChem (CID 66773814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).