4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline

C165H105N7 — CID 59561697

About 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline

4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline (PubChem CID 59561697) has the molecular formula C165H105N7 and a molecular weight of 2185.70 g/mol. Its IUPAC name is 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline.

Molecular Properties

• Compound Name: 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline
• PubChem CID: 59561697
• Molecular Formula: C165H105N7
• Molecular Weight: 2185.70 g/mol
• Exact Mass: 2183.84
• IUPAC Name: 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline
• SMILES: c1cc(-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)cc(C2(c3ccc(N(c4ccc(C5(c6cccc(-c7cc(-n8c9ccccc9c9ccccc98)cc(-n8c9ccccc9c9ccccc98)c7)c6)c6ccccc6-c6ccccc65)cc4)c4ccc(C5(c6cccc(-c7cc(-n8c9ccccc9c9ccccc98)cc(-n8c9ccccc9c9ccccc98)c7)c6)c6ccccc6-c6ccccc65)cc4)cc3)c3ccccc3-c3ccccc32)c1
• InChI: InChI=1S/C165H105N7/c1-19-64-145-127(46-1)128-47-2-20-65-146(128)163(145,115-43-37-40-106(94-115)109-97-121(167-151-70-25-7-52-133(151)134-53-8-26-71-152(134)167)103-122(98-109)168-153-72-27-9-54-135(153)136-55-10-28-73-154(136)168)112-82-88-118(89-83-112)166(119-90-84-113(85-91-119)164(147-66-21-3-48-129(147)130-49-4-22-67-148(130)164)116-44-38-41-107(95-116)110-99-123(169-155-74-29-11-56-137(155)138-57-12-30-75-156(138)169)104-124(100-110)170-157-76-31-13-58-139(157)140-59-14-32-77-158(140)170)120-92-86-114(87-93-120)165(149-68-23-5-50-131(149)132-51-6-24-69-150(132)165)117-45-39-42-108(96-117)111-101-125(171-159-78-33-15-60-141(159)142-61-16-34-79-160(142)171)105-126(102-111)172-161-80-35-17-62-143(161)144-63-18-36-81-162(144)172/h1-105H
• InChIKey: JUYODHPFAAZOBL-UHFFFAOYSA-N
• XLogP: 41.83
• TPSA: 32.82 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 18
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2185.70
LogP ≤ 5	41.83
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline?

The IUPAC name of 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline (CID 59561697) is 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline.

What is the SMILES notation for 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline?

The canonical SMILES for 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline is c1cc(-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)cc(C2(c3ccc(N(c4ccc(C5(c6cccc(-c7cc(-n8c9ccccc9c9ccccc98)cc(-n8c9ccccc9c9ccccc98)c7)c6)c6ccccc6-c6ccccc65)cc4)c4ccc(C5(c6cccc(-c7cc(-n8c9ccccc9c9ccccc98)cc(-n8c9ccccc9c9ccccc98)c7)c6)c6ccccc6-c6ccccc65)cc4)cc3)c3ccccc3-c3ccccc32)c1.

What is the InChIKey of 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline?

The InChIKey is JUYODHPFAAZOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C165H105N7/c1-19-64-145-127(46-1)128-47-2-20-65-146(128)163(145,115-43-37-40-106(94-115)109-97-121(167-151-70-25-7-52-133(151)134-53-8-26-71-152(134)167)103-122(98-109)168-153-72-27-9-54-135(153)136-55-10-28-73-154(136)168)112-82-88-118(89-83-112)166(119-90-84-113(85-91-119)164(147-66-21-3-48-129(147)130-49-4-22-67-148(130)164)116-44-38-41-107(95-116)110-99-123(169-155-74-29-11-56-137(155)138-57-12-30-75-156(138)169)104-124(100-110)170-157-76-31-13-58-139(157)140-59-14-32-77-158(140)170)120-92-86-114(87-93-120)165(149-68-23-5-50-131(149)132-51-6-24-69-150(132)165)117-45-39-42-108(96-117)111-101-125(171-159-78-33-15-60-141(159)142-61-16-34-79-160(142)171)105-126(102-111)172-161-80-35-17-62-143(161)144-63-18-36-81-162(144)172/h1-105H.

What are the key properties of 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline?

4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline has a molecular weight of 2185.70 g/mol, XLogP of 41.83, 18 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]-N,N-bis[4-[9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]fluoren-9-yl]phenyl]aniline is sourced from PubChem (CID 59561697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).