9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole

C43H28BrN — CID 167526147

IUPAC9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole
SMILESBrc1cc2c(cc1-c1cccc(-n3c4ccccc4c4ccccc43)c1)-c1ccccc1C2(c1ccccc1)c1ccccc1
InChIInChI=1S/C43H28BrN/c44-40-28-39-37(33-20-7-10-23-38(33)43(39,30-15-3-1-4-16-30)31-17-5-2-6-18-31)27-36(40)29-14-13-19-32(26-29)45-41-24-11-8-21-34(41)35-22-9-12-25-42(35)45/h1-28H
InChIKeyQCOHOCAFYJJOPF-UHFFFAOYSA-N
MW638.61 g/mol
LogP11.58
Rot. Bonds4

About 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole

9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole (PubChem CID 167526147) has the molecular formula C43H28BrN and a molecular weight of 638.61 g/mol. Its IUPAC name is 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole.

Molecular Properties

Compound Name9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole
PubChem CID167526147
Molecular FormulaC43H28BrN
Molecular Weight638.61 g/mol
Exact Mass637.14
IUPAC Name9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole
SMILESBrc1cc2c(cc1-c1cccc(-n3c4ccccc4c4ccccc43)c1)-c1ccccc1C2(c1ccccc1)c1ccccc1
InChIInChI=1S/C43H28BrN/c44-40-28-39-37(33-20-7-10-23-38(33)43(39,30-15-3-1-4-16-30)31-17-5-2-6-18-31)27-36(40)29-14-13-19-32(26-29)45-41-24-11-8-21-34(41)35-22-9-12-25-42(35)45/h1-28H
InChIKeyQCOHOCAFYJJOPF-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

methane;9-[3-(9-phenylfluoren-9-yl)phenyl]carbazole
CID 158348177
7,7-diphenyl-5-(3-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]indeno[2,1-b]carbazole;11,11-diphenyl-5-(3-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]indeno[1,2-b]carbazole
CID 161280871
11,11-diphenyl-5-[3-(10-tetraphenylen-2-ylanthracen-9-yl)phenyl]indeno[1,2-b]carbazole
CID 138553243
7,7-diphenyl-5-(4-phenylphenyl)-2-[9-(3-phenylphenyl)carbazol-3-yl]indeno[2,1-b]carbazole;11,11-diphenyl-5-(4-phenylphenyl)-2-[9-(3-phenylphenyl)carbazol-3-yl]indeno[1,2-b]carbazole
CID 158074658
3-[9-[4-[3-[4-[3-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 154590573
9-phenyl-3-(9-phenylfluoren-9-yl)-6-[9-(3-phenylphenyl)carbazol-3-yl]carbazole
CID 121311550
3-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]-9-[3-[9-[4-[4-[9-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-9-yl]phenyl]phenyl]carbazol-3-yl]phenyl]carbazole
CID 146517009
2-[3-(4-bromophenyl)phenyl]-9-[3-(9,9-diphenylfluoren-1-yl)phenyl]carbazole
CID 90216135
3-[9-[3-[3-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 154590619
[3-(3-carbazol-9-ylphenyl)phenyl]-diphenyl-[3-(9-phenylfluoren-9-yl)phenyl]silane
CID 155602586
2-[3-(4-bromophenyl)phenyl]-9-(9,9-diphenylfluoren-2-yl)carbazole
CID 90216005
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[3-[4-[4-[3-[9-[3-(4-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590364

Frequently Asked Questions

What is the IUPAC name of 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole?
The IUPAC name of 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole (CID 167526147) is 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole.
What is the SMILES notation for 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole?
The canonical SMILES for 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole is Brc1cc2c(cc1-c1cccc(-n3c4ccccc4c4ccccc43)c1)-c1ccccc1C2(c1ccccc1)c1ccccc1.
What is the InChIKey of 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole?
The InChIKey is QCOHOCAFYJJOPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28BrN/c44-40-28-39-37(33-20-7-10-23-38(33)43(39,30-15-3-1-4-16-30)31-17-5-2-6-18-31)27-36(40)29-14-13-19-32(26-29)45-41-24-11-8-21-34(41)35-22-9-12-25-42(35)45/h1-28H.
What are the key properties of 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole?
9-[3-(2-bromo-9,9-diphenylfluoren-3-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 9-[3-(2-bromo-9,9-diphenylfluoren-3-yl)phenyl]carbazole is sourced from PubChem (CID 167526147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).