2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole

C43H28BrN — CID 90216123

IUPAC2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole
SMILESBrc1ccc2c3ccccc3n(-c3ccc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c2c1
InChIInChI=1S/C43H28BrN/c44-32-24-27-36-35-16-8-10-21-40(35)45(41(36)28-32)33-25-22-29(23-26-33)34-18-11-20-39-42(34)37-17-7-9-19-38(37)43(39,30-12-3-1-4-13-30)31-14-5-2-6-15-31/h1-28H
InChIKeyDOKSELYMPDXZKS-UHFFFAOYSA-N
MW638.61 g/mol
LogP11.58
Rot. Bonds4

About 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole

2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole (PubChem CID 90216123) has the molecular formula C43H28BrN and a molecular weight of 638.61 g/mol. Its IUPAC name is 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole.

Molecular Properties

Compound Name2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole
PubChem CID90216123
Molecular FormulaC43H28BrN
Molecular Weight638.61 g/mol
Exact Mass637.14
IUPAC Name2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole
SMILESBrc1ccc2c3ccccc3n(-c3ccc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c2c1
InChIInChI=1S/C43H28BrN/c44-32-24-27-36-35-16-8-10-21-40(35)45(41(36)28-32)33-25-22-29(23-26-33)34-18-11-20-39-42(34)37-17-7-9-19-38(37)43(39,30-12-3-1-4-13-30)31-14-5-2-6-15-31/h1-28H
InChIKeyDOKSELYMPDXZKS-UHFFFAOYSA-N
XLogP11.58
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500638.61
LogP ≤ 511.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

20-[4-(9,9-diphenylfluoren-4-yl)phenyl]-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14,16,18,21,23-dodecaene
CID 134580544
9-[4-(9,9-diphenylfluoren-4-yl)phenyl]-2-[3-(3-methylphenyl)phenyl]carbazole
CID 90216056
2-[3-(2-bromophenyl)phenyl]-9-(9,9-diphenylfluoren-3-yl)carbazole;2-[3-(2-bromophenyl)phenyl]-9-(9,9-diphenylfluoren-4-yl)carbazole;2-[3-(2-bromophenyl)phenyl]-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole
CID 158943768
2-[3-(4-bromophenyl)phenyl]-9-(9,9-diphenylfluoren-2-yl)carbazole
CID 90216005
2-bromo-9-phenyl-6-(9-phenylfluoren-9-yl)carbazole
CID 167214778
2-bromo-9-(4-naphthalen-1-ylphenyl)carbazole
CID 130250089
9-[4-[4-(9,9-diphenylfluoren-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 126543721
N-(3-carbazol-9-ylphenyl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-diphenylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-diphenylfluoren-2-amine
CID 159606680
[3-[3-[2-(9,9-diphenylfluoren-4-yl)carbazol-9-yl]carbazol-9-yl]phenyl]-triphenylsilane
CID 166588365
5-[4-(4-carbazol-9-ylphenyl)phenyl]-11,11-diphenylindeno[1,2-b]carbazole
CID 168783626
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-diphenylfluoren-2-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-diphenylfluoren-2-amine
CID 158727335
N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-N-(4-naphtho[1,2-b][1]benzofuran-10-ylphenyl)-9-phenylcarbazol-2-amine
CID 177122433

Frequently Asked Questions

What is the IUPAC name of 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole?
The IUPAC name of 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole (CID 90216123) is 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole.
What is the SMILES notation for 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole?
The canonical SMILES for 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole is Brc1ccc2c3ccccc3n(-c3ccc(-c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c2c1.
What is the InChIKey of 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole?
The InChIKey is DOKSELYMPDXZKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28BrN/c44-32-24-27-36-35-16-8-10-21-40(35)45(41(36)28-32)33-25-22-29(23-26-33)34-18-11-20-39-42(34)37-17-7-9-19-38(37)43(39,30-12-3-1-4-13-30)31-14-5-2-6-15-31/h1-28H.
What are the key properties of 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole?
2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole has a molecular weight of 638.61 g/mol, XLogP of 11.58, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-9-[4-(9,9-diphenylfluoren-4-yl)phenyl]carbazole is sourced from PubChem (CID 90216123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).