9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole

C112H84N4 — CID 161360746

IUPAC9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
SMILESCc1ccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1.Cc1cccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c1.Cc1cccc(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c1.Cc1ccccc1-n1c2ccccc2c2cc(-c3ccccc3)ccc21
InChIInChI=1S/2C31H23N.2C25H19N/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;1-22-12-16-27(17-13-22)32-30-18-14-25(23-8-4-2-5-9-23)20-28(30)29-21-26(15-19-31(29)32)24-10-6-3-7-11-24;1-18-9-5-7-13-23(18)26-24-14-8-6-12-21(24)22-17-20(15-16-25(22)26)19-10-3-2-4-11-19;1-18-8-7-11-21(16-18)26-24-13-6-5-12-22(24)23-17-20(14-15-25(23)26)19-9-3-2-4-10-19/h2*2-21H,1H3;2*2-17H,1H3
InChIKeyVPDFYVYIVOFBQB-UHFFFAOYSA-N
MW1485.93 g/mol
LogP30.37
Rot. Bonds10

About 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole

9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole (PubChem CID 161360746) has the molecular formula C112H84N4 and a molecular weight of 1485.93 g/mol. Its IUPAC name is 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole.

Molecular Properties

Compound Name9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
PubChem CID161360746
Molecular FormulaC112H84N4
Molecular Weight1485.93 g/mol
Exact Mass1484.67
IUPAC Name9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
SMILESCc1ccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1.Cc1cccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c1.Cc1cccc(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c1.Cc1ccccc1-n1c2ccccc2c2cc(-c3ccccc3)ccc21
InChIInChI=1S/2C31H23N.2C25H19N/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;1-22-12-16-27(17-13-22)32-30-18-14-25(23-8-4-2-5-9-23)20-28(30)29-21-26(15-19-31(29)32)24-10-6-3-7-11-24;1-18-9-5-7-13-23(18)26-24-14-8-6-12-21(24)22-17-20(15-16-25(22)26)19-10-3-2-4-11-19;1-18-8-7-11-21(16-18)26-24-13-6-5-12-22(24)23-17-20(14-15-25(23)26)19-9-3-2-4-10-19/h2*2-21H,1H3;2*2-17H,1H3
InChIKeyVPDFYVYIVOFBQB-UHFFFAOYSA-N
XLogP30.37
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms116
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001485.93
LogP ≤ 530.37
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
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
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole
CID 162048953
3-methyl-9-(2-methylphenyl)-6-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]carbazole;3-methyl-9-(4-methylphenyl)-6-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]carbazole;3-[9-(2-methylphenyl)carbazol-3-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;3-[9-(4-methylphenyl)carbazol-3-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 161215741
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
3-methyl-6-[6-methyl-9-(3-methylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 174182038
3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 67964803
3-[4-[9-[4-(4-methylphenyl)phenyl]carbazol-3-yl]phenyl]-9-phenylcarbazole
CID 121287007
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
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-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole?
The IUPAC name of 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole (CID 161360746) is 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole.
What is the SMILES notation for 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole?
The canonical SMILES for 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole is Cc1ccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1.Cc1cccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)c1.Cc1cccc(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c1.Cc1ccccc1-n1c2ccccc2c2cc(-c3ccccc3)ccc21.
What is the InChIKey of 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole?
The InChIKey is VPDFYVYIVOFBQB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C31H23N.2C25H19N/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;1-22-12-16-27(17-13-22)32-30-18-14-25(23-8-4-2-5-9-23)20-28(30)29-21-26(15-19-31(29)32)24-10-6-3-7-11-24;1-18-9-5-7-13-23(18)26-24-14-8-6-12-21(24)22-17-20(15-16-25(22)26)19-10-3-2-4-11-19;1-18-8-7-11-21(16-18)26-24-13-6-5-12-22(24)23-17-20(14-15-25(23)26)19-9-3-2-4-10-19/h2*2-21H,1H3;2*2-17H,1H3.
What are the key properties of 9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole?
9-(3-methylphenyl)-3,6-diphenylcarbazole;9-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole has a molecular weight of 1485.93 g/mol, XLogP of 30.37, 10 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-(4-methylphenyl)-3,6-diphenylcarbazole;9-(2-methylphenyl)-3-phenylcarbazole;9-(3-methylphenyl)-3-phenylcarbazole is sourced from PubChem (CID 161360746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).