diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane

C24H15F25O6Si2 — CID 158411675

IUPACdiethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane
SMILESCCO[Si](OCC)(OC(F)(F)C(F)(F)F)c1ccccc1.Fc1c(F)c(F)c([Si](OC(F)(F)C(F)(F)F)(OC(F)(F)C(F)(F)F)OC(F)(F)C(F)(F)F)c(F)c1F
InChIInChI=1S/C12F20O3Si.C12H15F5O3Si/c13-1-2(14)4(16)6(5(17)3(1)15)36(33-10(27,28)7(18,19)20,34-11(29,30)8(21,22)23)35-12(31,32)9(24,25)26;1-3-18-21(19-4-2,10-8-6-5-7-9-10)20-12(16,17)11(13,14)15/h;5-9H,3-4H2,1-2H3
InChIKeyGZJUYINQUHACOU-UHFFFAOYSA-N
MW930.50 g/mol
LogP9.12
Rot. Bonds14

About diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane

diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane (PubChem CID 158411675) has the molecular formula C24H15F25O6Si2 and a molecular weight of 930.50 g/mol. Its IUPAC name is diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane.

Molecular Properties

Compound Namediethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane
PubChem CID158411675
Molecular FormulaC24H15F25O6Si2
Molecular Weight930.50 g/mol
Exact Mass930.00
IUPAC Namediethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane
SMILESCCO[Si](OCC)(OC(F)(F)C(F)(F)F)c1ccccc1.Fc1c(F)c(F)c([Si](OC(F)(F)C(F)(F)F)(OC(F)(F)C(F)(F)F)OC(F)(F)C(F)(F)F)c(F)c1F
InChIInChI=1S/C12F20O3Si.C12H15F5O3Si/c13-1-2(14)4(16)6(5(17)3(1)15)36(33-10(27,28)7(18,19)20,34-11(29,30)8(21,22)23)35-12(31,32)9(24,25)26;1-3-18-21(19-4-2,10-8-6-5-7-9-10)20-12(16,17)11(13,14)15/h;5-9H,3-4H2,1-2H3
InChIKeyGZJUYINQUHACOU-UHFFFAOYSA-N
XLogP9.12
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500930.50
LogP ≤ 59.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Analyze diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane?
The IUPAC name of diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane (CID 158411675) is diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane.
What is the SMILES notation for diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane?
The canonical SMILES for diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane is CCO[Si](OCC)(OC(F)(F)C(F)(F)F)c1ccccc1.Fc1c(F)c(F)c([Si](OC(F)(F)C(F)(F)F)(OC(F)(F)C(F)(F)F)OC(F)(F)C(F)(F)F)c(F)c1F.
What is the InChIKey of diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane?
The InChIKey is GZJUYINQUHACOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12F20O3Si.C12H15F5O3Si/c13-1-2(14)4(16)6(5(17)3(1)15)36(33-10(27,28)7(18,19)20,34-11(29,30)8(21,22)23)35-12(31,32)9(24,25)26;1-3-18-21(19-4-2,10-8-6-5-7-9-10)20-12(16,17)11(13,14)15/h;5-9H,3-4H2,1-2H3.
What are the key properties of diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane?
diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane has a molecular weight of 930.50 g/mol, XLogP of 9.12, 14 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-(1,1,2,2,2-pentafluoroethoxy)-phenylsilane;tris(1,1,2,2,2-pentafluoroethoxy)-(2,3,4,5,6-pentafluorophenyl)silane is sourced from PubChem (CID 158411675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).