2-fluoroethoxy-hexadecoxy-diphenylsilane

C30H47FO2Si — CID 91717518

IUPAC2-fluoroethoxy-hexadecoxy-diphenylsilane
SMILESCCCCCCCCCCCCCCCCO[Si](OCCF)(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H47FO2Si/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-27-32-34(33-28-26-31,29-22-17-15-18-23-29)30-24-19-16-20-25-30/h15-20,22-25H,2-14,21,26-28H2,1H3
InChIKeyHEXOPKRSDQSWRA-UHFFFAOYSA-N
MW486.79 g/mol
LogP7.73
Rot. Bonds21

About 2-fluoroethoxy-hexadecoxy-diphenylsilane

2-fluoroethoxy-hexadecoxy-diphenylsilane (PubChem CID 91717518) has the molecular formula C30H47FO2Si and a molecular weight of 486.79 g/mol. Its IUPAC name is 2-fluoroethoxy-hexadecoxy-diphenylsilane.

Molecular Properties

Compound Name2-fluoroethoxy-hexadecoxy-diphenylsilane
PubChem CID91717518
Molecular FormulaC30H47FO2Si
Molecular Weight486.79 g/mol
Exact Mass486.33
IUPAC Name2-fluoroethoxy-hexadecoxy-diphenylsilane
SMILESCCCCCCCCCCCCCCCCO[Si](OCCF)(c1ccccc1)c1ccccc1
InChIInChI=1S/C30H47FO2Si/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-27-32-34(33-28-26-31,29-22-17-15-18-23-29)30-24-19-16-20-25-30/h15-20,22-25H,2-14,21,26-28H2,1H3
InChIKeyHEXOPKRSDQSWRA-UHFFFAOYSA-N
XLogP7.73
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds21
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500486.79
LogP ≤ 57.73
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

Diphenyldiethoxysilane
CID 75705
Diphenyl-dipropoxy-silane
CID 14324871
Tert-butyl-cycloheptyloxy-diphenylsilane
CID 90682026
6-((tert-Butyldiphenylsilyl)oxy)hexan-1-ol
CID 11013734
tert-Butyl(hexyloxy)diphenylsilane
CID 11338517
Dibutoxy(diphenyl)silane
CID 13637536
1-Dimethyl(phenyl)silyloxy-10-undecene
CID 586346
9-[Tert-butyl(diphenyl)silyl]oxynonan-1-ol
CID 14940128
tert-butyl-[(2R)-hept-6-en-2-yl]oxy-diphenylsilane
CID 44178593
1-Phenyl-3-dimethyl(pentafluorophenyl)silyloxypropane
CID 576398
Silane, diphenylheptyloxy(1,1,1-trifluoro-3-bromoprop-2-yloxy)-
CID 91699488
Silane, diphenylundecyloxy(1,1,1-trifluoro-3-bromoprop-2-yloxy)-
CID 91699830

Frequently Asked Questions

What is the IUPAC name of 2-fluoroethoxy-hexadecoxy-diphenylsilane?
The IUPAC name of 2-fluoroethoxy-hexadecoxy-diphenylsilane (CID 91717518) is 2-fluoroethoxy-hexadecoxy-diphenylsilane.
What is the SMILES notation for 2-fluoroethoxy-hexadecoxy-diphenylsilane?
The canonical SMILES for 2-fluoroethoxy-hexadecoxy-diphenylsilane is CCCCCCCCCCCCCCCCO[Si](OCCF)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-fluoroethoxy-hexadecoxy-diphenylsilane?
The InChIKey is HEXOPKRSDQSWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H47FO2Si/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21-27-32-34(33-28-26-31,29-22-17-15-18-23-29)30-24-19-16-20-25-30/h15-20,22-25H,2-14,21,26-28H2,1H3.
What are the key properties of 2-fluoroethoxy-hexadecoxy-diphenylsilane?
2-fluoroethoxy-hexadecoxy-diphenylsilane has a molecular weight of 486.79 g/mol, XLogP of 7.73, 21 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethoxy-hexadecoxy-diphenylsilane is sourced from PubChem (CID 91717518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).