9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine

C132H95BrN2 — CID 159169386

About 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine

9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine (PubChem CID 159169386) has the molecular formula C132H95BrN2 and a molecular weight of 1789.13 g/mol. Its IUPAC name is 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine.

Molecular Properties

• Compound Name: 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine
• PubChem CID: 159169386
• Molecular Formula: C132H95BrN2
• Molecular Weight: 1789.13 g/mol
• Exact Mass: 1786.67
• IUPAC Name: 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine
• SMILES: Brc1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(Nc3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21
• InChI: InChI=1S/C66H47N.C40H31N.C26H17Br/c1-65(2)59-32-18-16-26-51(59)53-40-38-49(42-61(53)65)67(50-39-41-54-52-27-17-19-33-60(52)66(62(54)43-50,46-22-8-4-9-23-46)47-24-10-5-11-25-47)48-36-34-45(35-37-48)64-57-30-14-12-28-55(57)63(44-20-6-3-7-21-44)56-29-13-15-31-58(56)64;1-39(2)35-19-11-9-17-31(35)33-23-21-29(25-37(33)39)41-30-22-24-34-32-18-10-12-20-36(32)40(38(34)26-30,27-13-5-3-6-14-27)28-15-7-4-8-16-28;27-20-16-14-19(15-17-20)26-23-12-6-4-10-21(23)25(18-8-2-1-3-9-18)22-11-5-7-13-24(22)26/h3-43H,1-2H3;3-26,41H,1-2H3;1-17H
• InChIKey: KLMHQDQLLGUANB-UHFFFAOYSA-N
• XLogP: 35.66
• TPSA: 15.27 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 13
• Heavy Atoms: 135
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1789.13
LogP ≤ 5	35.66
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine?

The IUPAC name of 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine (CID 159169386) is 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine.

What is the SMILES notation for 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine?

The canonical SMILES for 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine is Brc1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(Nc3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.

What is the InChIKey of 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine?

The InChIKey is KLMHQDQLLGUANB-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H47N.C40H31N.C26H17Br/c1-65(2)59-32-18-16-26-51(59)53-40-38-49(42-61(53)65)67(50-39-41-54-52-27-17-19-33-60(52)66(62(54)43-50,46-22-8-4-9-23-46)47-24-10-5-11-25-47)48-36-34-45(35-37-48)64-57-30-14-12-28-55(57)63(44-20-6-3-7-21-44)56-29-13-15-31-58(56)64;1-39(2)35-19-11-9-17-31(35)33-23-21-29(25-37(33)39)41-30-22-24-34-32-18-10-12-20-36(32)40(38(34)26-30,27-13-5-3-6-14-27)28-15-7-4-8-16-28;27-20-16-14-19(15-17-20)26-23-12-6-4-10-21(23)25(18-8-2-1-3-9-18)22-11-5-7-13-24(22)26/h3-43H,1-2H3;3-26,41H,1-2H3;1-17H.

What are the key properties of 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine?

9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine has a molecular weight of 1789.13 g/mol, XLogP of 35.66, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 9-(4-bromophenyl)-10-phenylanthracene;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(10-phenylanthracen-9-yl)phenyl]fluoren-2-amine is sourced from PubChem (CID 159169386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).