N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

C187H190B5Br2Cl6N7O10 — CID 160904288

About N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (PubChem CID 160904288) has the molecular formula C187H190B5Br2Cl6N7O10 and a molecular weight of 3122.20 g/mol. Its IUPAC name is N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

Molecular Properties

• Compound Name: N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• PubChem CID: 160904288
• Molecular Formula: C187H190B5Br2Cl6N7O10
• Molecular Weight: 3122.20 g/mol
• Exact Mass: 3116.15
• IUPAC Name: N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
• SMILES: Brc1ccc2c(c1)[nH]c1ccccc12.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2ccc(N(c3ccc(Cl)cc3)c3ccc(Cl)cc3)cc2)OC1(C)C.CCCCCCc1ccc(-n2c3ccccc3c3ccc(-c4ccc(N(c5ccc(B6OC(C)(C)C(C)(C)O6)cc5)c5ccc(B6OC(C)(C)C(C)(C)O6)cc5)cc4)cc32)cc1.CCCCCCc1ccc(-n2c3ccccc3c3ccc(-c4ccc(N(c5ccc(Cl)cc5)c5ccc(Cl)cc5)cc4)cc32)cc1.CCCCCCc1ccc(Br)cc1.Clc1ccc(N(c2ccc(Cl)cc2)c2ccc(-c3ccc4c(c3)Cc3ccccc3-4)cc2)cc1
• InChI: InChI=1S/C54H60B2N2O4.C42H36Cl2N2.C31H21Cl2N.C24H24BCl2NO2.C12H24B2O4.C12H8BrN.C12H17Br/c1-10-11-12-13-16-38-19-28-46(29-20-38)58-49-18-15-14-17-47(49)48-36-23-40(37-50(48)58)39-21-30-43(31-22-39)57(44-32-24-41(25-33-44)55-59-51(2,3)52(4,5)60-55)45-34-26-42(27-35-45)56-61-53(6,7)54(8,9)62-56;1-2-3-4-5-8-30-11-20-38(21-12-30)46-41-10-7-6-9-39(41)40-28-15-32(29-42(40)46)31-13-22-35(23-14-31)45(36-24-16-33(43)17-25-36)37-26-18-34(44)19-27-37;32-25-8-14-28(15-9-25)34(29-16-10-26(33)11-17-29)27-12-5-21(6-13-27)22-7-18-31-24(19-22)20-23-3-1-2-4-30(23)31;1-23(2)24(3,4)30-25(29-23)17-5-11-20(12-6-17)28(21-13-7-18(26)8-14-21)22-15-9-19(27)10-16-22;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;13-8-5-6-10-9-3-1-2-4-11(9)14-12(10)7-8;1-2-3-4-5-6-11-7-9-12(13)10-8-11/h14-15,17-37H,10-13,16H2,1-9H3;6-7,9-29H,2-5,8H2,1H3;1-19H,20H2;5-16H,1-4H3;1-8H3;1-7,14H;7-10H,2-6H2,1H3
• InChIKey: SPXPKMSDWDHIMV-UHFFFAOYSA-N
• XLogP: 53.36
• TPSA: 130.91 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 16
• Rotatable Bonds: 36
• Heavy Atoms: 217
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3122.20
LogP ≤ 5	53.36
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The IUPAC name of N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (CID 160904288) is N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

What is the SMILES notation for N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The canonical SMILES for N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is Brc1ccc2c(c1)[nH]c1ccccc12.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.CC1(C)OB(c2ccc(N(c3ccc(Cl)cc3)c3ccc(Cl)cc3)cc2)OC1(C)C.CCCCCCc1ccc(-n2c3ccccc3c3ccc(-c4ccc(N(c5ccc(B6OC(C)(C)C(C)(C)O6)cc5)c5ccc(B6OC(C)(C)C(C)(C)O6)cc5)cc4)cc32)cc1.CCCCCCc1ccc(-n2c3ccccc3c3ccc(-c4ccc(N(c5ccc(Cl)cc5)c5ccc(Cl)cc5)cc4)cc32)cc1.CCCCCCc1ccc(Br)cc1.Clc1ccc(N(c2ccc(Cl)cc2)c2ccc(-c3ccc4c(c3)Cc3ccccc3-4)cc2)cc1.

What is the InChIKey of N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

The InChIKey is SPXPKMSDWDHIMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H60B2N2O4.C42H36Cl2N2.C31H21Cl2N.C24H24BCl2NO2.C12H24B2O4.C12H8BrN.C12H17Br/c1-10-11-12-13-16-38-19-28-46(29-20-38)58-49-18-15-14-17-47(49)48-36-23-40(37-50(48)58)39-21-30-43(31-22-39)57(44-32-24-41(25-33-44)55-59-51(2,3)52(4,5)60-55)45-34-26-42(27-35-45)56-61-53(6,7)54(8,9)62-56;1-2-3-4-5-8-30-11-20-38(21-12-30)46-41-10-7-6-9-39(41)40-28-15-32(29-42(40)46)31-13-22-35(23-14-31)45(36-24-16-33(43)17-25-36)37-26-18-34(44)19-27-37;32-25-8-14-28(15-9-25)34(29-16-10-26(33)11-17-29)27-12-5-21(6-13-27)22-7-18-31-24(19-22)20-23-3-1-2-4-30(23)31;1-23(2)24(3,4)30-25(29-23)17-5-11-20(12-6-17)28(21-13-7-18(26)8-14-21)22-15-9-19(27)10-16-22;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;13-8-5-6-10-9-3-1-2-4-11(9)14-12(10)7-8;1-2-3-4-5-6-11-7-9-12(13)10-8-11/h14-15,17-37H,10-13,16H2,1-9H3;6-7,9-29H,2-5,8H2,1H3;1-19H,20H2;5-16H,1-4H3;1-8H3;1-7,14H;7-10H,2-6H2,1H3.

What are the key properties of N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?

N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane has a molecular weight of 3122.20 g/mol, XLogP of 53.36, 36 rotatable bonds, 1 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-bis(4-chlorophenyl)-4-(9H-fluoren-2-yl)aniline;N,N-bis(4-chlorophenyl)-4-[9-(4-hexylphenyl)carbazol-2-yl]aniline;N,N-bis(4-chlorophenyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;2-bromo-9H-carbazole;1-bromo-4-hexylbenzene;N-[4-[9-(4-hexylphenyl)carbazol-2-yl]phenyl]-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]aniline;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is sourced from PubChem (CID 160904288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).