9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole

C44H27Br2N — CID 71062116

IUPAC9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole
SMILESBrc1cc(Br)cc(-n2c3ccc(-c4ccc5c(c4)Cc4ccccc4-5)cc3c3cc(-c4ccc5c(c4)Cc4ccccc4-5)ccc32)c1
InChIInChI=1S/C44H27Br2N/c45-34-23-35(46)25-36(24-34)47-43-15-11-28(26-9-13-39-32(17-26)19-30-5-1-3-7-37(30)39)21-41(43)42-22-29(12-16-44(42)47)27-10-14-40-33(18-27)20-31-6-2-4-8-38(31)40/h1-18,21-25H,19-20H2
InChIKeyDKPLJSVYBYFCJB-UHFFFAOYSA-N
MW729.52 g/mol
LogP12.79
Rot. Bonds3

About 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole

9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole (PubChem CID 71062116) has the molecular formula C44H27Br2N and a molecular weight of 729.52 g/mol. Its IUPAC name is 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole.

Molecular Properties

Compound Name9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole
PubChem CID71062116
Molecular FormulaC44H27Br2N
Molecular Weight729.52 g/mol
Exact Mass727.05
IUPAC Name9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole
SMILESBrc1cc(Br)cc(-n2c3ccc(-c4ccc5c(c4)Cc4ccccc4-5)cc3c3cc(-c4ccc5c(c4)Cc4ccccc4-5)ccc32)c1
InChIInChI=1S/C44H27Br2N/c45-34-23-35(46)25-36(24-34)47-43-15-11-28(26-9-13-39-32(17-26)19-30-5-1-3-7-37(30)39)21-41(43)42-22-29(12-16-44(42)47)27-10-14-40-33(18-27)20-31-6-2-4-8-38(31)40/h1-18,21-25H,19-20H2
InChIKeyDKPLJSVYBYFCJB-UHFFFAOYSA-N
XLogP12.79
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500729.52
LogP ≤ 512.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[9-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)carbazol-3-yl]-9-(3,5-dibromophenyl)carbazole
CID 159278200
2-[9-(9H-fluoren-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 121241600
9-(9H-fluoren-2-yl)-3,6-bis(4-naphthalen-1-ylphenyl)carbazole
CID 118475206
3-[9-[3-(9H-fluoren-2-yl)naphthalen-1-yl]carbazol-3-yl]-9-phenylcarbazole
CID 126753402
9-[7-(9H-fluoren-2-yl)-9H-fluoren-2-yl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 170285115
9-(7-naphthalen-1-yl-9H-fluoren-2-yl)-3,6-bis(4-naphthalen-1-ylphenyl)carbazole
CID 118475106
2-bromo-9,9-dimethylfluorene;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-(9H-fluoren-3-yl)-9-(4-phenylphenyl)carbazole
CID 157054225
N-[4-(9H-fluoren-2-yl)phenyl]-N-phenyl-2-(9-phenylcarbazol-3-yl)aniline
CID 143813917
CID 162260109
CID 162260109
3,6-di(phenanthren-9-yl)-9-(7-phenanthren-9-yl-9H-fluoren-2-yl)carbazole
CID 118475131
9-(7-phenanthren-9-yl-9H-fluoren-2-yl)-3,6-bis[4-(4-phenanthren-9-ylphenyl)phenyl]carbazole
CID 118475080
3,6-ditert-butyl-9-(9H-fluoren-2-yl)carbazole
CID 158328553

Frequently Asked Questions

What is the IUPAC name of 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole?
The IUPAC name of 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole (CID 71062116) is 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole.
What is the SMILES notation for 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole?
The canonical SMILES for 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole is Brc1cc(Br)cc(-n2c3ccc(-c4ccc5c(c4)Cc4ccccc4-5)cc3c3cc(-c4ccc5c(c4)Cc4ccccc4-5)ccc32)c1.
What is the InChIKey of 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole?
The InChIKey is DKPLJSVYBYFCJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H27Br2N/c45-34-23-35(46)25-36(24-34)47-43-15-11-28(26-9-13-39-32(17-26)19-30-5-1-3-7-37(30)39)21-41(43)42-22-29(12-16-44(42)47)27-10-14-40-33(18-27)20-31-6-2-4-8-38(31)40/h1-18,21-25H,19-20H2.
What are the key properties of 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole?
9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole has a molecular weight of 729.52 g/mol, XLogP of 12.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3,5-dibromophenyl)-3,6-bis(9H-fluoren-2-yl)carbazole is sourced from PubChem (CID 71062116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).