2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline

C121H98BrN2Si2- — CID 157271018

About 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline

2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline (PubChem CID 157271018) has the molecular formula C121H98BrN2Si2- and a molecular weight of 1716.20 g/mol. Its IUPAC name is 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline.

Molecular Properties

• Compound Name: 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline
• PubChem CID: 157271018
• Molecular Formula: C121H98BrN2Si2-
• Molecular Weight: 1716.20 g/mol
• Exact Mass: 1713.65
• IUPAC Name: 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline
• SMILES: CC1(C)c2ccccc2-c2ccc(-c3ccc(Br)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc21.[CH3-].c1ccc(-c2ccc(Nc3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1
• InChI: InChI=1S/C63H49NSi.C36H29NSi.C21H17Br.CH3/c1-63(2)61-26-16-15-25-59(61)60-44-35-51(45-62(60)63)50-31-40-54(41-32-50)64(52-36-27-47(28-37-52)46-17-7-3-8-18-46)53-38-29-48(30-39-53)49-33-42-58(43-34-49)65(55-19-9-4-10-20-55,56-21-11-5-12-22-56)57-23-13-6-14-24-57;1-5-13-29(14-6-1)30-21-23-31(24-22-30)37-32-25-27-36(28-26-32)38(33-15-7-2-8-16-33,34-17-9-3-10-18-34)35-19-11-4-12-20-35;1-21(2)19-6-4-3-5-17(19)18-12-9-15(13-20(18)21)14-7-10-16(22)11-8-14;/h3-45H,1-2H3;1-28,37H;3-13H,1-2H3;1H3/q;;;-1
• InChIKey: AYNQLZLNVHNBLB-UHFFFAOYSA-N
• XLogP: 27.19
• TPSA: 15.27 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 18
• Heavy Atoms: 126
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1716.20
LogP ≤ 5	27.19
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline?

The IUPAC name of 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline (CID 157271018) is 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline.

What is the SMILES notation for 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline?

The canonical SMILES for 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline is CC1(C)c2ccccc2-c2ccc(-c3ccc(Br)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc21.[CH3-].c1ccc(-c2ccc(Nc3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1.

What is the InChIKey of 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline?

The InChIKey is AYNQLZLNVHNBLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H49NSi.C36H29NSi.C21H17Br.CH3/c1-63(2)61-26-16-15-25-59(61)60-44-35-51(45-62(60)63)50-31-40-54(41-32-50)64(52-36-27-47(28-37-52)46-17-7-3-8-18-46)53-38-29-48(30-39-53)49-33-42-58(43-34-49)65(55-19-9-4-10-20-55,56-21-11-5-12-22-56)57-23-13-6-14-24-57;1-5-13-29(14-6-1)30-21-23-31(24-22-30)37-32-25-27-36(28-26-32)38(33-15-7-2-8-16-33,34-17-9-3-10-18-34)35-19-11-4-12-20-35;1-21(2)19-6-4-3-5-17(19)18-12-9-15(13-20(18)21)14-7-10-16(22)11-8-14;/h3-45H,1-2H3;1-28,37H;3-13H,1-2H3;1H3/q;;;-1.

What are the key properties of 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline?

2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline has a molecular weight of 1716.20 g/mol, XLogP of 27.19, 18 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-bromophenyl)-9,9-dimethylfluorene;carbanide;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenyl-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;4-phenyl-N-(4-triphenylsilylphenyl)aniline is sourced from PubChem (CID 157271018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).