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

C103H74BrN3 — CID 157054225

IUPAC2-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
SMILESCC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccccc6)cc5)ccc43)cc21.CC1(C)c2ccccc2-c2ccc(Br)cc21.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)-c5ccccc5C6)ccc43)cc2)cc1
InChIInChI=1S/C51H36N2.C37H25N.C15H13Br/c1-51(2)45-17-9-6-14-39(45)40-27-26-38(32-46(40)51)53-48-19-11-8-16-42(48)44-31-36(23-29-50(44)53)35-22-28-49-43(30-35)41-15-7-10-18-47(41)52(49)37-24-20-34(21-25-37)33-12-4-3-5-13-33;1-2-8-25(9-3-1)26-16-19-31(20-17-26)38-36-13-7-6-12-33(36)35-24-28(18-21-37(35)38)27-14-15-30-22-29-10-4-5-11-32(29)34(30)23-27;1-15(2)13-6-4-3-5-11(13)12-8-7-10(16)9-14(12)15/h3-32H,1-2H3;1-21,23-24H,22H2;3-9H,1-2H3
InChIKeyAAOGJIAHSBRJHR-UHFFFAOYSA-N
MW1433.65 g/mol
LogP27.97
Rot. Bonds7

About 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

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 (PubChem CID 157054225) has the molecular formula C103H74BrN3 and a molecular weight of 1433.65 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2-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
PubChem CID157054225
Molecular FormulaC103H74BrN3
Molecular Weight1433.65 g/mol
Exact Mass1431.51
IUPAC Name2-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
SMILESCC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccccc6)cc5)ccc43)cc21.CC1(C)c2ccccc2-c2ccc(Br)cc21.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)-c5ccccc5C6)ccc43)cc2)cc1
InChIInChI=1S/C51H36N2.C37H25N.C15H13Br/c1-51(2)45-17-9-6-14-39(45)40-27-26-38(32-46(40)51)53-48-19-11-8-16-42(48)44-31-36(23-29-50(44)53)35-22-28-49-43(30-35)41-15-7-10-18-47(41)52(49)37-24-20-34(21-25-37)33-12-4-3-5-13-33;1-2-8-25(9-3-1)26-16-19-31(20-17-26)38-36-13-7-6-12-33(36)35-24-28(18-21-37(35)38)27-14-15-30-22-29-10-4-5-11-32(29)34(30)23-27;1-15(2)13-6-4-3-5-11(13)12-8-7-10(16)9-14(12)15/h3-32H,1-2H3;1-21,23-24H,22H2;3-9H,1-2H3
InChIKeyAAOGJIAHSBRJHR-UHFFFAOYSA-N
XLogP27.97
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms107
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001433.65
LogP ≤ 527.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 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 with MolForge

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Related Compounds

3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 163801693
2-bromo-9,9-dimethylfluorene;2-bromo-9-phenylcarbazole;9H-fluoren-3-ylboronic acid;bis(2-(9H-fluoren-3-yl)-9-phenylcarbazole)
CID 158945415
3-bromo-9-(9,9-dimethylfluoren-2-yl)carbazole
CID 89472048
3,6-bis[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 59306698
3-[4-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]phenyl]-9-(6-phenylnaphthalen-2-yl)carbazole;3-[4-[9-(6-phenylnaphthalen-2-yl)carbazol-3-yl]phenyl]-9-(3-phenylphenyl)carbazole
CID 160879378
2-carbazol-9-yl-7,7-dimethyl-5-(4-phenylphenyl)indeno[2,1-b]carbazole;7,7-dimethyl-2-[4-(9-phenylcarbazol-3-yl)phenyl]-5-(4-phenylphenyl)indeno[2,1-b]carbazole
CID 159588417
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-(9-naphthalen-2-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
CID 159796041
9,14-bis(4-phenylphenyl)-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;9-(9,9-dimethylfluoren-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;9,14-diphenyl-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;9-phenyl-14-(4-phenylphenyl)-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 162005580
9-(9H-fluoren-3-yl)-14-[9-methyl-9-(trideuteriomethyl)fluoren-2-yl]-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 122595603
9-(4-bromophenyl)-10-phenylanthracene;methane;9-[4-(10-phenylanthracen-9-yl)phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-phenyl-3-[6-(9-phenylcarbazol-3-yl)-9H-fluoren-3-yl]carbazole
CID 159346046
9-(9,9-dimethyl-7-phenylfluoren-2-yl)-3,6-diphenylcarbazole
CID 118475086
3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 158323830

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccccc6)cc5)ccc43)cc21.CC1(C)c2ccccc2-c2ccc(Br)cc21.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)-c5ccccc5C6)ccc43)cc2)cc1.
What is the InChIKey of 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?
The InChIKey is AAOGJIAHSBRJHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H36N2.C37H25N.C15H13Br/c1-51(2)45-17-9-6-14-39(45)40-27-26-38(32-46(40)51)53-48-19-11-8-16-42(48)44-31-36(23-29-50(44)53)35-22-28-49-43(30-35)41-15-7-10-18-47(41)52(49)37-24-20-34(21-25-37)33-12-4-3-5-13-33;1-2-8-25(9-3-1)26-16-19-31(20-17-26)38-36-13-7-6-12-33(36)35-24-28(18-21-37(35)38)27-14-15-30-22-29-10-4-5-11-32(29)34(30)23-27;1-15(2)13-6-4-3-5-11(13)12-8-7-10(16)9-14(12)15/h3-32H,1-2H3;1-21,23-24H,22H2;3-9H,1-2H3.
What are the key properties of 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?
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 has a molecular weight of 1433.65 g/mol, XLogP of 27.97, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 157054225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).