butoxy-diethyl-(2-phenylethoxy)silane

C16H28O2Si — CID 91738633

IUPACbutoxy-diethyl-(2-phenylethoxy)silane
SMILESCCCCO[Si](CC)(CC)OCCc1ccccc1
InChIInChI=1S/C16H28O2Si/c1-4-7-14-17-19(5-2,6-3)18-15-13-16-11-9-8-10-12-16/h8-12H,4-7,13-15H2,1-3H3
InChIKeyWSKMDTXBNZQHAB-UHFFFAOYSA-N
MW280.48 g/mol
LogP4.54
Rot. Bonds10

About butoxy-diethyl-(2-phenylethoxy)silane

butoxy-diethyl-(2-phenylethoxy)silane (PubChem CID 91738633) has the molecular formula C16H28O2Si and a molecular weight of 280.48 g/mol. Its IUPAC name is butoxy-diethyl-(2-phenylethoxy)silane.

Molecular Properties

Compound Namebutoxy-diethyl-(2-phenylethoxy)silane
PubChem CID91738633
Molecular FormulaC16H28O2Si
Molecular Weight280.48 g/mol
Exact Mass280.19
IUPAC Namebutoxy-diethyl-(2-phenylethoxy)silane
SMILESCCCCO[Si](CC)(CC)OCCc1ccccc1
InChIInChI=1S/C16H28O2Si/c1-4-7-14-17-19(5-2,6-3)18-15-13-16-11-9-8-10-12-16/h8-12H,4-7,13-15H2,1-3H3
InChIKeyWSKMDTXBNZQHAB-UHFFFAOYSA-N
XLogP4.54
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.48
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Methyl phenethyl ether
CID 19089
Isoamyl phenethyl ether
CID 91978
Benzene, (2-ethoxyethyl)-
CID 74556
Butyl phenethyl ether
CID 79240
Benzyloxytrimethylsilane
CID 518982
Triethoxy(p-tolyl)silane
CID 4670738
Benzyltriethoxysilane
CID 75690
Benzene, [1-[(trimethylsilyl)oxy]ethenyl]-
CID 117406
Benzene, (2-(trimethoxysilyl)ethyl)-
CID 170789
Benzene, ((ethoxydimethylsilyl)methyl)-
CID 86972
Tert-butyl[(4-iodophenyl)methoxy]dimethylsilane
CID 10020633
Benzyl(methoxy)dimethylsilane
CID 12749810

Frequently Asked Questions

What is the IUPAC name of butoxy-diethyl-(2-phenylethoxy)silane?
The IUPAC name of butoxy-diethyl-(2-phenylethoxy)silane (CID 91738633) is butoxy-diethyl-(2-phenylethoxy)silane.
What is the SMILES notation for butoxy-diethyl-(2-phenylethoxy)silane?
The canonical SMILES for butoxy-diethyl-(2-phenylethoxy)silane is CCCCO[Si](CC)(CC)OCCc1ccccc1.
What is the InChIKey of butoxy-diethyl-(2-phenylethoxy)silane?
The InChIKey is WSKMDTXBNZQHAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28O2Si/c1-4-7-14-17-19(5-2,6-3)18-15-13-16-11-9-8-10-12-16/h8-12H,4-7,13-15H2,1-3H3.
What are the key properties of butoxy-diethyl-(2-phenylethoxy)silane?
butoxy-diethyl-(2-phenylethoxy)silane has a molecular weight of 280.48 g/mol, XLogP of 4.54, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-diethyl-(2-phenylethoxy)silane is sourced from PubChem (CID 91738633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).