diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane

C66H50F76O10Si5 — CID 159414731

IUPACdiethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane
SMILESCCO[Si](OCC)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.CCO[Si](OCC)(C(F)=C(F)F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F.CCO[Si](OCC)(C(F)=C(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.CCO[Si](OCC)(C(F)=C(F)F)C(F)=C(F)F.CCO[Si](OCC)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(C(F)=C(F)F)c(F)c1F
InChIInChI=1S/C18H10F12O2Si.C16H10F26O2Si.C14H10F20O2Si.C10H10F12O2Si.C8H10F6O2Si/c1-3-31-33(32-4-2,17-14(27)10(23)9(22)11(24)15(17)28)16-12(25)6(19)5(7(20)13(16)26)8(21)18(29)30;1-3-43-45(44-4-2,15(39,40)11(29,30)7(21,22)5(17,18)9(25,26)13(33,34)35)16(41,42)12(31,32)8(23,24)6(19,20)10(27,28)14(36,37)38;1-3-35-37(36-4-2,6(17)5(15)16)14(33,34)12(28,29)10(24,25)8(20,21)7(18,19)9(22,23)11(26,27)13(30,31)32;1-3-23-25(24-4-2,6(13)5(11)12)7(8(14,15)16,9(17,18)19)10(20,21)22;1-3-15-17(16-4-2,7(13)5(9)10)8(14)6(11)12/h3-4H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3
InChIKeyLPAGAWRGMVHHSG-UHFFFAOYSA-N
MW2587.39 g/mol
LogP31.11
Rot. Bonds45

About diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane

diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane (PubChem CID 159414731) has the molecular formula C66H50F76O10Si5 and a molecular weight of 2587.39 g/mol. Its IUPAC name is diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane.

Molecular Properties

Compound Namediethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane
PubChem CID159414731
Molecular FormulaC66H50F76O10Si5
Molecular Weight2587.39 g/mol
Exact Mass2586.10
IUPAC Namediethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane
SMILESCCO[Si](OCC)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.CCO[Si](OCC)(C(F)=C(F)F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F.CCO[Si](OCC)(C(F)=C(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.CCO[Si](OCC)(C(F)=C(F)F)C(F)=C(F)F.CCO[Si](OCC)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(C(F)=C(F)F)c(F)c1F
InChIInChI=1S/C18H10F12O2Si.C16H10F26O2Si.C14H10F20O2Si.C10H10F12O2Si.C8H10F6O2Si/c1-3-31-33(32-4-2,17-14(27)10(23)9(22)11(24)15(17)28)16-12(25)6(19)5(7(20)13(16)26)8(21)18(29)30;1-3-43-45(44-4-2,15(39,40)11(29,30)7(21,22)5(17,18)9(25,26)13(33,34)35)16(41,42)12(31,32)8(23,24)6(19,20)10(27,28)14(36,37)38;1-3-35-37(36-4-2,6(17)5(15)16)14(33,34)12(28,29)10(24,25)8(20,21)7(18,19)9(22,23)11(26,27)13(30,31)32;1-3-23-25(24-4-2,6(13)5(11)12)7(8(14,15)16,9(17,18)19)10(20,21)22;1-3-15-17(16-4-2,7(13)5(9)10)8(14)6(11)12/h3-4H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3
InChIKeyLPAGAWRGMVHHSG-UHFFFAOYSA-N
XLogP31.11
TPSA92.30 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds45
Heavy Atoms157
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002587.39
LogP ≤ 531.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane with MolForge

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Frequently Asked Questions

What is the IUPAC name of diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane?
The IUPAC name of diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane (CID 159414731) is diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane.
What is the SMILES notation for diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane?
The canonical SMILES for diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane is CCO[Si](OCC)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.CCO[Si](OCC)(C(F)=C(F)F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F.CCO[Si](OCC)(C(F)=C(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.CCO[Si](OCC)(C(F)=C(F)F)C(F)=C(F)F.CCO[Si](OCC)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(C(F)=C(F)F)c(F)c1F.
What is the InChIKey of diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane?
The InChIKey is LPAGAWRGMVHHSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10F12O2Si.C16H10F26O2Si.C14H10F20O2Si.C10H10F12O2Si.C8H10F6O2Si/c1-3-31-33(32-4-2,17-14(27)10(23)9(22)11(24)15(17)28)16-12(25)6(19)5(7(20)13(16)26)8(21)18(29)30;1-3-43-45(44-4-2,15(39,40)11(29,30)7(21,22)5(17,18)9(25,26)13(33,34)35)16(41,42)12(31,32)8(23,24)6(19,20)10(27,28)14(36,37)38;1-3-35-37(36-4-2,6(17)5(15)16)14(33,34)12(28,29)10(24,25)8(20,21)7(18,19)9(22,23)11(26,27)13(30,31)32;1-3-23-25(24-4-2,6(13)5(11)12)7(8(14,15)16,9(17,18)19)10(20,21)22;1-3-15-17(16-4-2,7(13)5(9)10)8(14)6(11)12/h3-4H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3;3-4H2,1-2H3.
What are the key properties of diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane?
diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane has a molecular weight of 2587.39 g/mol, XLogP of 31.11, 45 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-bis(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)silane;diethoxy-bis(1,2,2-trifluoroethenyl)silane;diethoxy-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-(1,2,2-trifluoroethenyl)silane;diethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]-(1,2,2-trifluoroethenyl)silane;diethoxy-(2,3,4,5,6-pentafluorophenyl)-[2,3,5,6-tetrafluoro-4-(1,2,2-trifluoroethenyl)phenyl]silane is sourced from PubChem (CID 159414731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).