silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene

C45H24AgBF20 — CID 22335858

IUPACsilver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene
SMILESCc1ccccc1.Cc1ccccc1.Cc1ccccc1.Fc1c(F)c(F)c([B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.[Ag+]
InChIInChI=1S/C24BF20.3C7H8.Ag/c26-5-1(6(27)14(35)21(42)13(5)34)25(2-7(28)15(36)22(43)16(37)8(2)29,3-9(30)17(38)23(44)18(39)10(3)31)4-11(32)19(40)24(45)20(41)12(4)33;3*1-7-5-3-2-4-6-7;/h;3*2-6H,1H3;/q-1;;;;+1
InChIKeyGBZHKSQRVZIXML-UHFFFAOYSA-N
MW1063.33 g/mol
LogP11.83
Rot. Bonds4

About silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene

silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene (PubChem CID 22335858) has the molecular formula C45H24AgBF20 and a molecular weight of 1063.33 g/mol. Its IUPAC name is silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene.

Molecular Properties

Compound Namesilver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene
PubChem CID22335858
Molecular FormulaC45H24AgBF20
Molecular Weight1063.33 g/mol
Exact Mass1062.07
IUPAC Namesilver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene
SMILESCc1ccccc1.Cc1ccccc1.Cc1ccccc1.Fc1c(F)c(F)c([B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.[Ag+]
InChIInChI=1S/C24BF20.3C7H8.Ag/c26-5-1(6(27)14(35)21(42)13(5)34)25(2-7(28)15(36)22(43)16(37)8(2)29,3-9(30)17(38)23(44)18(39)10(3)31)4-11(32)19(40)24(45)20(41)12(4)33;3*1-7-5-3-2-4-6-7;/h;3*2-6H,1H3;/q-1;;;;+1
InChIKeyGBZHKSQRVZIXML-UHFFFAOYSA-N
XLogP11.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001063.33
LogP ≤ 511.83
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'}

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Related Compounds

iodobenzene;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide
CID 22222054
bis(4-methylphenyl)iodanium;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide
CID 22035133
bis(dimethyl(phenyl)azanium);hydron;tris(tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide)
CID 139997769
methyl(phenyl)azanium;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide
CID 23352825
dimethyl-[(4-methylphenyl)methyl]-phenylazanium;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide
CID 142413098
1-benzyl-4-(4-methylphenyl)pyridin-1-ium;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide
CID 139731848
sodium (2,3,4,5,6-pentafluorophenyl)-triphenylboranuide
CID 139835857
tetramethylazanium;tris(2,3,4,5,6-pentafluorophenyl)-phenylboranuide
CID 11498397
(3-methylphenyl)methyl-triphenylphosphanium;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide
CID 139734585
methylcyclotriacontapentadecaene
CID 101240530
titanium(2+);toluene
CID 22023820
benzene;toluene
CID 158487474

Frequently Asked Questions

What is the IUPAC name of silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene?
The IUPAC name of silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene (CID 22335858) is silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene.
What is the SMILES notation for silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene?
The canonical SMILES for silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene is Cc1ccccc1.Cc1ccccc1.Cc1ccccc1.Fc1c(F)c(F)c([B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.[Ag+].
What is the InChIKey of silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene?
The InChIKey is GBZHKSQRVZIXML-UHFFFAOYSA-N. The full InChI is InChI=1S/C24BF20.3C7H8.Ag/c26-5-1(6(27)14(35)21(42)13(5)34)25(2-7(28)15(36)22(43)16(37)8(2)29,3-9(30)17(38)23(44)18(39)10(3)31)4-11(32)19(40)24(45)20(41)12(4)33;3*1-7-5-3-2-4-6-7;/h;3*2-6H,1H3;/q-1;;;;+1.
What are the key properties of silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene?
silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene has a molecular weight of 1063.33 g/mol, XLogP of 11.83, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for silver;tetrakis(2,3,4,5,6-pentafluorophenyl)boranuide;toluene is sourced from PubChem (CID 22335858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).