diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane

C16H10F10O2Si — CID 11102434

IUPACdiethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane
SMILESCCO[Si](OCC)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C16H10F10O2Si/c1-3-27-29(28-4-2,15-11(23)7(19)5(17)8(20)12(15)24)16-13(25)9(21)6(18)10(22)14(16)26/h3-4H2,1-2H3
InChIKeyXJYMDGOGWVHLFW-UHFFFAOYSA-N
MW452.32 g/mol
LogP3.71
Rot. Bonds6

About diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane

diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane (PubChem CID 11102434) has the molecular formula C16H10F10O2Si and a molecular weight of 452.32 g/mol. Its IUPAC name is diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane.

Molecular Properties

Compound Namediethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane
PubChem CID11102434
Molecular FormulaC16H10F10O2Si
Molecular Weight452.32 g/mol
Exact Mass452.03
IUPAC Namediethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane
SMILESCCO[Si](OCC)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C16H10F10O2Si/c1-3-27-29(28-4-2,15-11(23)7(19)5(17)8(20)12(15)24)16-13(25)9(21)6(18)10(22)14(16)26/h3-4H2,1-2H3
InChIKeyXJYMDGOGWVHLFW-UHFFFAOYSA-N
XLogP3.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500452.32
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(Triethoxysilyl)pentafluorobenzene
CID 2782625
Disiloxane, 1,1,3,3-tetramethyl-1,3-bis(pentafluorophenyl)-
CID 593150
Trimethoxy(pentafluorophenyl)silane
CID 2782640
Methoxytris(pentafluorophenyl)silane
CID 2783338
1-Dimethyl(pentafluorophenyl)silyloxypropane
CID 523425
Pentafluorophenylethoxydimethylsilane
CID 523441
Silane, methoxydimethyl(pentafluorophenyl)-
CID 523444
Dimethoxybis(pentafluorophenyl)silane
CID 2769655
Pentafluorophenyl(vinyl)dimethoxysilane
CID 22389966
Ethenyl(diethoxy)(pentafluorophenyl)silane
CID 23523559
1-Dimethyl(pentafluorophenyl)silyloxybutane
CID 523424
2-Dimethyl(pentafluorophenyl)silyloxybutane
CID 523426

Frequently Asked Questions

What is the IUPAC name of diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane?
The IUPAC name of diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane (CID 11102434) is diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane.
What is the SMILES notation for diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane?
The canonical SMILES for diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane is CCO[Si](OCC)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane?
The InChIKey is XJYMDGOGWVHLFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F10O2Si/c1-3-27-29(28-4-2,15-11(23)7(19)5(17)8(20)12(15)24)16-13(25)9(21)6(18)10(22)14(16)26/h3-4H2,1-2H3.
What are the key properties of diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane?
diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane has a molecular weight of 452.32 g/mol, XLogP of 3.71, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-bis(2,3,4,5,6-pentafluorophenyl)silane is sourced from PubChem (CID 11102434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).