diethoxy-phenyl-(4-phenylbutan-2-yl)silane

C20H28O2Si — CID 153412292

IUPACdiethoxy-phenyl-(4-phenylbutan-2-yl)silane
SMILESCCO[Si](OCC)(c1ccccc1)C(C)CCc1ccccc1
InChIInChI=1S/C20H28O2Si/c1-4-21-23(22-5-2,20-14-10-7-11-15-20)18(3)16-17-19-12-8-6-9-13-19/h6-15,18H,4-5,16-17H2,1-3H3
InChIKeyGZRQHIIBEOEBPL-UHFFFAOYSA-N
MW328.53 g/mol
LogP4.43
Rot. Bonds9

About diethoxy-phenyl-(4-phenylbutan-2-yl)silane

diethoxy-phenyl-(4-phenylbutan-2-yl)silane (PubChem CID 153412292) has the molecular formula C20H28O2Si and a molecular weight of 328.53 g/mol. Its IUPAC name is diethoxy-phenyl-(4-phenylbutan-2-yl)silane.

Molecular Properties

Compound Namediethoxy-phenyl-(4-phenylbutan-2-yl)silane
PubChem CID153412292
Molecular FormulaC20H28O2Si
Molecular Weight328.53 g/mol
Exact Mass328.19
IUPAC Namediethoxy-phenyl-(4-phenylbutan-2-yl)silane
SMILESCCO[Si](OCC)(c1ccccc1)C(C)CCc1ccccc1
InChIInChI=1S/C20H28O2Si/c1-4-21-23(22-5-2,20-14-10-7-11-15-20)18(3)16-17-19-12-8-6-9-13-19/h6-15,18H,4-5,16-17H2,1-3H3
InChIKeyGZRQHIIBEOEBPL-UHFFFAOYSA-N
XLogP4.43
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.53
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane
CID 54185163
3-phenyl-1-triethoxysilylpropane-1-thiol
CID 175065982
1,4-diphenylbutan-2-yl(triethoxy)silane
CID 174529704
3,4-dimethylhexylbenzene
CID 72602417
(2S)-4-phenylbutan-2-amine
CID 6994564
phenyl-tri(propan-2-yloxy)silane;triethoxy(phenyl)silane
CID 159737253
1,1-diethoxyethane;2-phenylethylbenzene
CID 66689331
(2R)-4-phenylbutane-2-thiol
CID 28974861
ethene;3-methylbutylbenzene
CID 145421013
ethane;triethoxy(phenyl)silane
CID 174836592
N,N-diethyl-4-phenylbutan-2-amine
CID 567866
2-methyl-4-phenylbutanoic acid
CID 66896591

Frequently Asked Questions

What is the IUPAC name of diethoxy-phenyl-(4-phenylbutan-2-yl)silane?
The IUPAC name of diethoxy-phenyl-(4-phenylbutan-2-yl)silane (CID 153412292) is diethoxy-phenyl-(4-phenylbutan-2-yl)silane.
What is the SMILES notation for diethoxy-phenyl-(4-phenylbutan-2-yl)silane?
The canonical SMILES for diethoxy-phenyl-(4-phenylbutan-2-yl)silane is CCO[Si](OCC)(c1ccccc1)C(C)CCc1ccccc1.
What is the InChIKey of diethoxy-phenyl-(4-phenylbutan-2-yl)silane?
The InChIKey is GZRQHIIBEOEBPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28O2Si/c1-4-21-23(22-5-2,20-14-10-7-11-15-20)18(3)16-17-19-12-8-6-9-13-19/h6-15,18H,4-5,16-17H2,1-3H3.
What are the key properties of diethoxy-phenyl-(4-phenylbutan-2-yl)silane?
diethoxy-phenyl-(4-phenylbutan-2-yl)silane has a molecular weight of 328.53 g/mol, XLogP of 4.43, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-phenyl-(4-phenylbutan-2-yl)silane is sourced from PubChem (CID 153412292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).