3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole

C231H204F19N9 — CID 157475508

IUPAC3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole
SMILESCC(C)(c1ccccc1)c1ccc(-n2c3ccc(C(C)(C)c4ccccc4)cc3c3cc(C(C)(C)c4ccccc4)ccc32)cc1.CC(C)(c1ccccc1)c1ccc(-n2c3ccc(C(c4ccccc4)(C(F)(F)F)C(F)(F)F)cc3c3cc(C(c4ccccc4)(C(F)(F)F)C(F)(F)F)ccc32)cc1.CC(C)(c1ccccc1)c1ccc2c(c1)c1cc(C(C)(C)c3ccccc3)ccc1n2-c1ccc(C(c2ccccn2)(C(F)(F)F)C(F)(F)F)cc1.Cc1cc(C)c(Cc2ccc3c(c2)c2cc(Cc4c(C)cc(C)cc4C)ccc2n3-c2cc(C)c(C)c(C)c2)c(C)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cc(C(C)(C)c2ccccn2)cc(C(C)(C)c2ccccn2)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(F)cc1
InChIInChI=1S/C45H31F12N.C45H43N.C44H36F6N2.C41H43N.C36H35N3.C20H16FN/c1-39(2,28-12-6-3-7-13-28)29-18-22-34(23-19-29)58-37-24-20-32(40(42(46,47)48,43(49,50)51)30-14-8-4-9-15-30)26-35(37)36-27-33(21-25-38(36)58)41(44(52,53)54,45(55,56)57)31-16-10-5-11-17-31;1-43(2,32-16-10-7-11-17-32)35-22-26-38(27-23-35)46-41-28-24-36(44(3,4)33-18-12-8-13-19-33)30-39(41)40-31-37(25-29-42(40)46)45(5,6)34-20-14-9-15-21-34;1-40(2,29-13-7-5-8-14-29)32-20-24-37-35(27-32)36-28-33(41(3,4)30-15-9-6-10-16-30)21-25-38(36)52(37)34-22-18-31(19-23-34)42(43(45,46)47,44(48,49)50)39-17-11-12-26-51-39;1-24-14-28(5)36(29(6)15-24)20-33-10-12-40-38(22-33)39-23-34(21-37-30(7)16-25(2)17-31(37)8)11-13-41(39)42(40)35-18-26(3)32(9)27(4)19-35;1-24-13-15-31-29(19-24)30-20-25(2)14-16-32(30)39(31)28-22-26(35(3,4)33-11-7-9-17-37-33)21-27(23-28)36(5,6)34-12-8-10-18-38-34;1-13-3-9-19-17(11-13)18-12-14(2)4-10-20(18)22(19)16-7-5-15(21)6-8-16/h3-27H,1-2H3;7-31H,1-6H3;5-28H,1-4H3;10-19,22-23H,20-21H2,1-9H3;7-23H,1-6H3;3-12H,1-2H3
InChIKeyBVNSJVZYSKSUDO-UHFFFAOYSA-N
MW3467.20 g/mol
LogP63.06
Rot. Bonds32

About 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole

3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole (PubChem CID 157475508) has the molecular formula C231H204F19N9 and a molecular weight of 3467.20 g/mol. Its IUPAC name is 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole.

Molecular Properties

Compound Name3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole
PubChem CID157475508
Molecular FormulaC231H204F19N9
Molecular Weight3467.20 g/mol
Exact Mass3464.59
IUPAC Name3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole
SMILESCC(C)(c1ccccc1)c1ccc(-n2c3ccc(C(C)(C)c4ccccc4)cc3c3cc(C(C)(C)c4ccccc4)ccc32)cc1.CC(C)(c1ccccc1)c1ccc(-n2c3ccc(C(c4ccccc4)(C(F)(F)F)C(F)(F)F)cc3c3cc(C(c4ccccc4)(C(F)(F)F)C(F)(F)F)ccc32)cc1.CC(C)(c1ccccc1)c1ccc2c(c1)c1cc(C(C)(C)c3ccccc3)ccc1n2-c1ccc(C(c2ccccn2)(C(F)(F)F)C(F)(F)F)cc1.Cc1cc(C)c(Cc2ccc3c(c2)c2cc(Cc4c(C)cc(C)cc4C)ccc2n3-c2cc(C)c(C)c(C)c2)c(C)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cc(C(C)(C)c2ccccn2)cc(C(C)(C)c2ccccn2)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(F)cc1
InChIInChI=1S/C45H31F12N.C45H43N.C44H36F6N2.C41H43N.C36H35N3.C20H16FN/c1-39(2,28-12-6-3-7-13-28)29-18-22-34(23-19-29)58-37-24-20-32(40(42(46,47)48,43(49,50)51)30-14-8-4-9-15-30)26-35(37)36-27-33(21-25-38(36)58)41(44(52,53)54,45(55,56)57)31-16-10-5-11-17-31;1-43(2,32-16-10-7-11-17-32)35-22-26-38(27-23-35)46-41-28-24-36(44(3,4)33-18-12-8-13-19-33)30-39(41)40-31-37(25-29-42(40)46)45(5,6)34-20-14-9-15-21-34;1-40(2,29-13-7-5-8-14-29)32-20-24-37-35(27-32)36-28-33(41(3,4)30-15-9-6-10-16-30)21-25-38(36)52(37)34-22-18-31(19-23-34)42(43(45,46)47,44(48,49)50)39-17-11-12-26-51-39;1-24-14-28(5)36(29(6)15-24)20-33-10-12-40-38(22-33)39-23-34(21-37-30(7)16-25(2)17-31(37)8)11-13-41(39)42(40)35-18-26(3)32(9)27(4)19-35;1-24-13-15-31-29(19-24)30-20-25(2)14-16-32(30)39(31)28-22-26(35(3,4)33-11-7-9-17-37-33)21-27(23-28)36(5,6)34-12-8-10-18-38-34;1-13-3-9-19-17(11-13)18-12-14(2)4-10-20(18)22(19)16-7-5-15(21)6-8-16/h3-27H,1-2H3;7-31H,1-6H3;5-28H,1-4H3;10-19,22-23H,20-21H2,1-9H3;7-23H,1-6H3;3-12H,1-2H3
InChIKeyBVNSJVZYSKSUDO-UHFFFAOYSA-N
XLogP63.06
TPSA68.25 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds32
Heavy Atoms259
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003467.20
LogP ≤ 563.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole?
The IUPAC name of 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole (CID 157475508) is 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole.
What is the SMILES notation for 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole?
The canonical SMILES for 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole is CC(C)(c1ccccc1)c1ccc(-n2c3ccc(C(C)(C)c4ccccc4)cc3c3cc(C(C)(C)c4ccccc4)ccc32)cc1.CC(C)(c1ccccc1)c1ccc(-n2c3ccc(C(c4ccccc4)(C(F)(F)F)C(F)(F)F)cc3c3cc(C(c4ccccc4)(C(F)(F)F)C(F)(F)F)ccc32)cc1.CC(C)(c1ccccc1)c1ccc2c(c1)c1cc(C(C)(C)c3ccccc3)ccc1n2-c1ccc(C(c2ccccn2)(C(F)(F)F)C(F)(F)F)cc1.Cc1cc(C)c(Cc2ccc3c(c2)c2cc(Cc4c(C)cc(C)cc4C)ccc2n3-c2cc(C)c(C)c(C)c2)c(C)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cc(C(C)(C)c2ccccn2)cc(C(C)(C)c2ccccn2)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(F)cc1.
What is the InChIKey of 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole?
The InChIKey is BVNSJVZYSKSUDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H31F12N.C45H43N.C44H36F6N2.C41H43N.C36H35N3.C20H16FN/c1-39(2,28-12-6-3-7-13-28)29-18-22-34(23-19-29)58-37-24-20-32(40(42(46,47)48,43(49,50)51)30-14-8-4-9-15-30)26-35(37)36-27-33(21-25-38(36)58)41(44(52,53)54,45(55,56)57)31-16-10-5-11-17-31;1-43(2,32-16-10-7-11-17-32)35-22-26-38(27-23-35)46-41-28-24-36(44(3,4)33-18-12-8-13-19-33)30-39(41)40-31-37(25-29-42(40)46)45(5,6)34-20-14-9-15-21-34;1-40(2,29-13-7-5-8-14-29)32-20-24-37-35(27-32)36-28-33(41(3,4)30-15-9-6-10-16-30)21-25-38(36)52(37)34-22-18-31(19-23-34)42(43(45,46)47,44(48,49)50)39-17-11-12-26-51-39;1-24-14-28(5)36(29(6)15-24)20-33-10-12-40-38(22-33)39-23-34(21-37-30(7)16-25(2)17-31(37)8)11-13-41(39)42(40)35-18-26(3)32(9)27(4)19-35;1-24-13-15-31-29(19-24)30-20-25(2)14-16-32(30)39(31)28-22-26(35(3,4)33-11-7-9-17-37-33)21-27(23-28)36(5,6)34-12-8-10-18-38-34;1-13-3-9-19-17(11-13)18-12-14(2)4-10-20(18)22(19)16-7-5-15(21)6-8-16/h3-27H,1-2H3;7-31H,1-6H3;5-28H,1-4H3;10-19,22-23H,20-21H2,1-9H3;7-23H,1-6H3;3-12H,1-2H3.
What are the key properties of 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole?
3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole has a molecular weight of 3467.20 g/mol, XLogP of 63.06, 32 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;3,6-bis(2-phenylpropan-2-yl)-9-[4-(2-phenylpropan-2-yl)phenyl]carbazole;9-[3,5-bis(2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-dimethylcarbazole;9-(4-fluorophenyl)-3,6-dimethylcarbazole;9-[4-(1,1,1,3,3,3-hexafluoro-2-pyridin-2-ylpropan-2-yl)phenyl]-3,6-bis(2-phenylpropan-2-yl)carbazole;9-(3,4,5-trimethylphenyl)-3,6-bis[(2,4,6-trimethylphenyl)methyl]carbazole is sourced from PubChem (CID 157475508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).