1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane

C23H28Cl10F10Si4 — CID 160860581

IUPAC1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane
SMILESC.C.C.C=Cc1c(F)c(F)c(F)c(F)c1F.Cl[SiH](Cl)CC[Si](Cl)(Cl)Cl.Fc1c(F)c(F)c(CC[Si](Cl)(Cl)CC[Si](Cl)(Cl)Cl)c(F)c1F
InChIInChI=1S/C10H8Cl5F5Si2.C8H3F5.C2H5Cl5Si2.3CH4/c11-21(12,3-4-22(13,14)15)2-1-5-6(16)8(18)10(20)9(19)7(5)17;1-2-3-4(9)6(11)8(13)7(12)5(3)10;3-8(4)1-2-9(5,6)7;;;/h1-4H2;2H,1H2;8H,1-2H2;3*1H4
InChIKeySKKRJGWUZVLAFJ-UHFFFAOYSA-N
MW961.33 g/mol
LogP14.77
Rot. Bonds10

About 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane

1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane (PubChem CID 160860581) has the molecular formula C23H28Cl10F10Si4 and a molecular weight of 961.33 g/mol. Its IUPAC name is 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane.

Molecular Properties

Compound Name1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane
PubChem CID160860581
Molecular FormulaC23H28Cl10F10Si4
Molecular Weight961.33 g/mol
Exact Mass955.80
IUPAC Name1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane
SMILESC.C.C.C=Cc1c(F)c(F)c(F)c(F)c1F.Cl[SiH](Cl)CC[Si](Cl)(Cl)Cl.Fc1c(F)c(F)c(CC[Si](Cl)(Cl)CC[Si](Cl)(Cl)Cl)c(F)c1F
InChIInChI=1S/C10H8Cl5F5Si2.C8H3F5.C2H5Cl5Si2.3CH4/c11-21(12,3-4-22(13,14)15)2-1-5-6(16)8(18)10(20)9(19)7(5)17;1-2-3-4(9)6(11)8(13)7(12)5(3)10;3-8(4)1-2-9(5,6)7;;;/h1-4H2;2H,1H2;8H,1-2H2;3*1H4
InChIKeySKKRJGWUZVLAFJ-UHFFFAOYSA-N
XLogP14.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500961.33
LogP ≤ 514.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane?
The IUPAC name of 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane (CID 160860581) is 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane.
What is the SMILES notation for 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane?
The canonical SMILES for 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane is C.C.C.C=Cc1c(F)c(F)c(F)c(F)c1F.Cl[SiH](Cl)CC[Si](Cl)(Cl)Cl.Fc1c(F)c(F)c(CC[Si](Cl)(Cl)CC[Si](Cl)(Cl)Cl)c(F)c1F.
What is the InChIKey of 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane?
The InChIKey is SKKRJGWUZVLAFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl5F5Si2.C8H3F5.C2H5Cl5Si2.3CH4/c11-21(12,3-4-22(13,14)15)2-1-5-6(16)8(18)10(20)9(19)7(5)17;1-2-3-4(9)6(11)8(13)7(12)5(3)10;3-8(4)1-2-9(5,6)7;;;/h1-4H2;2H,1H2;8H,1-2H2;3*1H4.
What are the key properties of 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane?
1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane has a molecular weight of 961.33 g/mol, XLogP of 14.77, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2,3,4,5,6-pentafluorobenzene;methane;trichloro-[2-[dichloro-[2-(2,3,4,5,6-pentafluorophenyl)ethyl]silyl]ethyl]silane;trichloro(2-dichlorosilylethyl)silane is sourced from PubChem (CID 160860581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).