9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole

C51H32BrN — CID 118349490

IUPAC9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole
SMILESBrc1cccc(-c2ccc3c4c5ccccc5ccc4n(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccc6ccccc6c4-5)c3c2)c1
InChIInChI=1S/C51H32BrN/c52-39-19-11-14-35(30-39)36-22-26-44-48(31-36)53(47-29-24-34-13-8-10-21-42(34)50(44)47)40-25-27-43-46(32-40)51(37-15-3-1-4-16-37,38-17-5-2-6-18-38)45-28-23-33-12-7-9-20-41(33)49(43)45/h1-32H
InChIKeySMISSPMGPDWWJU-UHFFFAOYSA-N
MW738.73 g/mol
LogP13.88
Rot. Bonds4

About 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole

9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole (PubChem CID 118349490) has the molecular formula C51H32BrN and a molecular weight of 738.73 g/mol. Its IUPAC name is 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole.

Molecular Properties

Compound Name9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole
PubChem CID118349490
Molecular FormulaC51H32BrN
Molecular Weight738.73 g/mol
Exact Mass737.17
IUPAC Name9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole
SMILESBrc1cccc(-c2ccc3c4c5ccccc5ccc4n(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccc6ccccc6c4-5)c3c2)c1
InChIInChI=1S/C51H32BrN/c52-39-19-11-14-35(30-39)36-22-26-44-48(31-36)53(47-29-24-34-13-8-10-21-42(34)50(44)47)40-25-27-43-46(32-40)51(37-15-3-1-4-16-37,38-17-5-2-6-18-38)45-28-23-33-12-7-9-20-41(33)49(43)45/h1-32H
InChIKeySMISSPMGPDWWJU-UHFFFAOYSA-N
XLogP13.88
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500738.73
LogP ≤ 513.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-bromophenyl)-9-(9,9-diphenylfluoren-1-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-2-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-3-yl)carbazole;2-(3-bromophenyl)-9-(9,9-diphenylfluoren-4-yl)carbazole
CID 158627410
2-(2-bromophenyl)-9-dibenzofuran-1-ylcarbazole;2-(2-bromophenyl)-9-dibenzofuran-3-ylcarbazole;2-(2-bromophenyl)-9-dibenzofuran-4-ylcarbazole;9-(2-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole
CID 161096724
2-[3-(4-bromophenyl)phenyl]-9-(9,9-diphenylfluoren-2-yl)carbazole
CID 90216005
9-(10-naphthalen-1-ylanthracen-9-yl)-7,7-diphenylbenzo[c]fluorene
CID 166034390
N-[4-(7,7-diphenylbenzo[g]fluoren-9-yl)phenyl]-N,9-diphenylcarbazol-3-amine
CID 135299725
2-[7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[g]carbazol-9-yl]-N,N-diphenylaniline;2-[12-(9,9-diphenylfluoren-2-yl)-12-azapentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaen-9-yl]-N,N-diphenylaniline;2-[12-(9,9-diphenylfluoren-3-yl)-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-9-yl]-N,N-diphenylaniline
CID 159485545
8-(9,9-diphenylfluoren-2-yl)-15-[4-(10-phenylanthracen-9-yl)phenyl]-15-azahexacyclo[12.11.0.02,11.04,9.016,25.019,24]pentacosa-1(14),2(11),3,5,7,9,12,16(25),17,19,21,23-dodecaene
CID 164740425
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-4-yl)-9,9'-spirobi[fluorene]-2-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-4-yl)-9,9'-spirobi[fluorene]-2-amine;N-(9,9-diphenylfluoren-4-yl)-7,7-diphenyl-N-(4-phenylphenyl)benzo[g]fluoren-9-amine
CID 161188931
9-(14,14-diphenyl-9-thiapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaen-17-yl)-3,6-diphenylcarbazole
CID 118098886
3-(3-bromophenyl)-9-(9,9'-spirobi[fluorene]-2-yl)carbazole
CID 90215122
2-[3-(3-bromophenyl)phenyl]-9-naphthalen-2-ylcarbazole
CID 90216158
2-[4-(3-bromophenyl)phenyl]-9-naphthalen-2-ylcarbazole
CID 118265635

Frequently Asked Questions

What is the IUPAC name of 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole?
The IUPAC name of 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole (CID 118349490) is 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole.
What is the SMILES notation for 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole?
The canonical SMILES for 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole is Brc1cccc(-c2ccc3c4c5ccccc5ccc4n(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccc6ccccc6c4-5)c3c2)c1.
What is the InChIKey of 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole?
The InChIKey is SMISSPMGPDWWJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H32BrN/c52-39-19-11-14-35(30-39)36-22-26-44-48(31-36)53(47-29-24-34-13-8-10-21-42(34)50(44)47)40-25-27-43-46(32-40)51(37-15-3-1-4-16-37,38-17-5-2-6-18-38)45-28-23-33-12-7-9-20-41(33)49(43)45/h1-32H.
What are the key properties of 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole?
9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole has a molecular weight of 738.73 g/mol, XLogP of 13.88, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-bromophenyl)-7-(7,7-diphenylbenzo[g]fluoren-9-yl)benzo[c]carbazole is sourced from PubChem (CID 118349490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).