9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole

C106H80N4 — CID 160614579

IUPAC9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
SMILESCc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.Cc1ccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc1.Cc1cccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c1.Cc1cccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c1
InChIInChI=1S/C31H23N.3C25H19N/c1-22-9-8-14-27(19-22)32-30-17-15-25(23-10-4-2-5-11-23)20-28(30)29-21-26(16-18-31(29)32)24-12-6-3-7-13-24;1-18-13-15-19(16-14-18)20-7-6-8-21(17-20)26-24-11-4-2-9-22(24)23-10-3-5-12-25(23)26;1-18-7-6-8-20(17-18)19-13-15-21(16-14-19)26-24-11-4-2-9-22(24)23-10-3-5-12-25(23)26;1-18-10-12-19(13-11-18)20-14-16-21(17-15-20)26-24-8-4-2-6-22(24)23-7-3-5-9-25(23)26/h2-21H,1H3;3*2-17H,1H3
InChIKeyRFXQQWFXMJXONO-UHFFFAOYSA-N
MW1409.83 g/mol
LogP28.70
Rot. Bonds9

About 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole

9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole (PubChem CID 160614579) has the molecular formula C106H80N4 and a molecular weight of 1409.83 g/mol. Its IUPAC name is 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole.

Molecular Properties

Compound Name9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
PubChem CID160614579
Molecular FormulaC106H80N4
Molecular Weight1409.83 g/mol
Exact Mass1408.64
IUPAC Name9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
SMILESCc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.Cc1ccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc1.Cc1cccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c1.Cc1cccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c1
InChIInChI=1S/C31H23N.3C25H19N/c1-22-9-8-14-27(19-22)32-30-17-15-25(23-10-4-2-5-11-23)20-28(30)29-21-26(16-18-31(29)32)24-12-6-3-7-13-24;1-18-13-15-19(16-14-18)20-7-6-8-21(17-20)26-24-11-4-2-9-22(24)23-10-3-5-12-25(23)26;1-18-7-6-8-20(17-18)19-13-15-21(16-14-19)26-24-11-4-2-9-22(24)23-10-3-5-12-25(23)26;1-18-10-12-19(13-11-18)20-14-16-21(17-15-20)26-24-8-4-2-6-22(24)23-7-3-5-9-25(23)26/h2-21H,1H3;3*2-17H,1H3
InChIKeyRFXQQWFXMJXONO-UHFFFAOYSA-N
XLogP28.70
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms110
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001409.83
LogP ≤ 528.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole
CID 158304172
3-[9-[4-[3-(3-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[3-(4-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 160753219
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
CID 162048953
3-methyl-6-[6-methyl-9-(3-methylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 174182038
3-[9-[3-methyl-5-(3-methylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 134370775
3-[3-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
CID 144639934
3-carbazol-9-yl-9-[4-[4-(3-methylphenyl)phenyl]phenyl]carbazole
CID 170198467
9-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118014168
3-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;3-(9-phenylcarbazol-3-yl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161279377
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[3-(4-phenylphenyl)phenyl]carbazole;3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 161418420
3-(9-phenylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-(3-phenylphenyl)-3-[9-(3-phenylphenyl)carbazol-3-yl]carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 158435002
3-(4-carbazol-9-ylphenyl)-9-(3-phenylphenyl)carbazole;3-(4-carbazol-9-ylphenyl)-9-(4-phenylphenyl)carbazole;3-(4-carbazol-9-ylphenyl)-9-[4-(4-phenylphenyl)phenyl]carbazole
CID 159533505

Frequently Asked Questions

What is the IUPAC name of 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole?
The IUPAC name of 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole (CID 160614579) is 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole.
What is the SMILES notation for 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole?
The canonical SMILES for 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole is Cc1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.Cc1ccc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc1.Cc1cccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c1.Cc1cccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c1.
What is the InChIKey of 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole?
The InChIKey is RFXQQWFXMJXONO-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H23N.3C25H19N/c1-22-9-8-14-27(19-22)32-30-17-15-25(23-10-4-2-5-11-23)20-28(30)29-21-26(16-18-31(29)32)24-12-6-3-7-13-24;1-18-13-15-19(16-14-18)20-7-6-8-21(17-20)26-24-11-4-2-9-22(24)23-10-3-5-12-25(23)26;1-18-7-6-8-20(17-18)19-13-15-21(16-14-19)26-24-11-4-2-9-22(24)23-10-3-5-12-25(23)26;1-18-10-12-19(13-11-18)20-14-16-21(17-15-20)26-24-8-4-2-6-22(24)23-7-3-5-9-25(23)26/h2-21H,1H3;3*2-17H,1H3.
What are the key properties of 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole?
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole has a molecular weight of 1409.83 g/mol, XLogP of 28.70, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-[3-(4-methylphenyl)phenyl]carbazole;9-[4-(3-methylphenyl)phenyl]carbazole;9-[4-(4-methylphenyl)phenyl]carbazole is sourced from PubChem (CID 160614579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).