7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline

C86H65Br2I3N2 — CID 165028912

About 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline

7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline (PubChem CID 165028912) has the molecular formula C86H65Br2I3N2 and a molecular weight of 1667.00 g/mol. Its IUPAC name is 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline.

Molecular Properties

• Compound Name: 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline
• PubChem CID: 165028912
• Molecular Formula: C86H65Br2I3N2
• Molecular Weight: 1667.00 g/mol
• Exact Mass: 1664.06
• IUPAC Name: 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline
• SMILES: CC1(C)c2cc(Br)ccc2-c2ccc(I)cc21.CC1(C)c2cc(Br)ccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5ccccc45)cc3)cc21.II.c1ccc(-c2ccc(Nc3ccc(-c4cccc5ccccc45)cc3)cc2)cc1
• InChI: InChI=1S/C43H32BrN.C28H21N.C15H12BrI.I2/c1-43(2)41-27-33(44)19-25-39(41)40-26-24-36(28-42(40)43)45(34-20-15-30(16-21-34)29-9-4-3-5-10-29)35-22-17-32(18-23-35)38-14-8-12-31-11-6-7-13-37(31)38;1-2-7-21(8-3-1)22-13-17-25(18-14-22)29-26-19-15-24(16-20-26)28-12-6-10-23-9-4-5-11-27(23)28;1-15(2)13-7-9(16)3-5-11(13)12-6-4-10(17)8-14(12)15;1-2/h3-28H,1-2H3;1-20,29H;3-8H,1-2H3
• InChIKey: MIFUQGUMTBOGNB-UHFFFAOYSA-N
• XLogP: 27.76
• TPSA: 15.27 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 9
• Heavy Atoms: 93
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1667.00
LogP ≤ 5	27.76
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline?

The IUPAC name of 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline (CID 165028912) is 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline.

What is the SMILES notation for 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline?

The canonical SMILES for 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline is CC1(C)c2cc(Br)ccc2-c2ccc(I)cc21.CC1(C)c2cc(Br)ccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5ccccc45)cc3)cc21.II.c1ccc(-c2ccc(Nc3ccc(-c4cccc5ccccc45)cc3)cc2)cc1.

What is the InChIKey of 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline?

The InChIKey is MIFUQGUMTBOGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H32BrN.C28H21N.C15H12BrI.I2/c1-43(2)41-27-33(44)19-25-39(41)40-26-24-36(28-42(40)43)45(34-20-15-30(16-21-34)29-9-4-3-5-10-29)35-22-17-32(18-23-35)38-14-8-12-31-11-6-7-13-37(31)38;1-2-7-21(8-3-1)22-13-17-25(18-14-22)29-26-19-15-24(16-20-26)28-12-6-10-23-9-4-5-11-27(23)28;1-15(2)13-7-9(16)3-5-11(13)12-6-4-10(17)8-14(12)15;1-2/h3-28H,1-2H3;1-20,29H;3-8H,1-2H3;.

What are the key properties of 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline?

7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline has a molecular weight of 1667.00 g/mol, XLogP of 27.76, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 7-bromo-9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;2-bromo-7-iodo-9,9-dimethylfluorene;molecular iodine;N-(4-naphthalen-1-ylphenyl)-4-phenylaniline is sourced from PubChem (CID 165028912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).