C200H136N8 — CID 158107407
3-[9-(9,9-dimethylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-diphenylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]-9-phenylcarbazole (PubChem CID 158107407) has the molecular formula C200H136N8 and a molecular weight of 2651.34 g/mol. Its IUPAC name is 3-[9-(9,9-dimethylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-diphenylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]-9-phenylcarbazole.
| Compound Name | 3-[9-(9,9-dimethylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-diphenylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]-9-phenylcarbazole |
|---|---|
| PubChem CID | 158107407 |
| Molecular Formula | C200H136N8 |
| Molecular Weight | 2651.34 g/mol |
| Exact Mass | 2649.09 |
| IUPAC Name | 3-[9-(9,9-dimethylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-diphenylfluoren-1-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(9,9-diphenylfluoren-3-yl)carbazol-3-yl]-9-phenylcarbazole |
| SMILES | CC1(C)c2ccccc2-c2cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)ccc21.CC1(C)c2ccccc2-c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c21.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5c4C(c4ccccc4)(c4ccccc4)c4ccccc4-5)ccc32)cc1 |
| InChI | InChI=1S/2C55H36N2.2C45H32N2/c1-4-17-39(18-5-1)55(40-19-6-2-7-20-40)48-27-13-10-23-42(48)45-26-16-30-53(54(45)55)57-50-29-15-12-25-44(50)47-36-38(32-34-52(47)57)37-31-33-51-46(35-37)43-24-11-14-28-49(43)56(51)41-21-8-3-9-22-41;1-4-16-39(17-5-1)55(40-18-6-2-7-19-40)49-25-13-10-22-43(49)46-36-42(30-31-50(46)55)57-52-27-15-12-24-45(52)48-35-38(29-33-54(48)57)37-28-32-53-47(34-37)44-23-11-14-26-51(44)56(53)41-20-8-3-9-21-41;1-45(2)38-19-9-6-15-32(38)35-18-12-22-43(44(35)45)47-40-21-11-8-17-34(40)37-28-30(24-26-42(37)47)29-23-25-41-36(27-29)33-16-7-10-20-39(33)46(41)31-13-4-3-5-14-31;1-45(2)39-17-9-6-14-33(39)36-28-32(22-23-40(36)45)47-42-19-11-8-16-35(42)38-27-30(21-25-44(38)47)29-20-24-43-37(26-29)34-15-7-10-18-41(34)46(43)31-12-4-3-5-13-31/h2*1-36H;2*3-28H,1-2H3 |
| InChIKey | FPZXAMKJTZJRLZ-UHFFFAOYSA-N |
| XLogP | 51.53 |
| TPSA | 39.44 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 208 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2651.34 |
| LogP ≤ 5 | 51.53 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |