C154H130N10O — CID 157129034
2-(4-dibenzofuran-4-ylphenyl)-4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazine;3-[4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethyl-2,7-diphenylfluoren-4-yl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine (PubChem CID 157129034) has the molecular formula C154H130N10O and a molecular weight of 2136.80 g/mol. Its IUPAC name is 2-(4-dibenzofuran-4-ylphenyl)-4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazine;3-[4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethyl-2,7-diphenylfluoren-4-yl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine.
| Compound Name | 2-(4-dibenzofuran-4-ylphenyl)-4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazine;3-[4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethyl-2,7-diphenylfluoren-4-yl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine |
|---|---|
| PubChem CID | 157129034 |
| Molecular Formula | C154H130N10O |
| Molecular Weight | 2136.80 g/mol |
| Exact Mass | 2135.04 |
| IUPAC Name | 2-(4-dibenzofuran-4-ylphenyl)-4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazine;3-[4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole;2-(9,9-dimethyl-2,7-diphenylfluoren-4-yl)-4,6-bis(3-phenylphenyl)-1,3,5-triazine |
| SMILES | CC(C)(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)(C)C)cc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)n3)c1-2.CC(C)(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)(C)C)cc(-c3nc(-c4ccccc4)nc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)n3)c1-2.CC1(C)c2cc(-c3ccccc3)ccc2-c2c(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cccc(-c5ccccc5)c4)n3)cc(-c3ccccc3)cc21 |
| InChI | InChI=1S/C54H39N3.C50H46N4.C50H45N3O/c1-54(2)48-34-42(38-21-11-5-12-22-38)29-30-46(48)50-47(33-45(35-49(50)54)39-23-13-6-14-24-39)53-56-51(43-27-15-25-40(31-43)36-17-7-3-8-18-36)55-52(57-53)44-28-16-26-41(32-44)37-19-9-4-10-20-37;1-48(2,3)33-24-25-37-40(29-33)50(7,8)41-30-34(49(4,5)6)28-39(44(37)41)47-52-45(31-17-11-9-12-18-31)51-46(53-47)32-23-26-43-38(27-32)36-21-15-16-22-42(36)54(43)35-19-13-10-14-20-35;1-48(2,3)33-25-26-38-40(28-33)50(7,8)41-29-34(49(4,5)6)27-39(43(38)41)47-52-45(31-15-10-9-11-16-31)51-46(53-47)32-23-21-30(22-24-32)35-18-14-19-37-36-17-12-13-20-42(36)54-44(35)37/h3-35H,1-2H3;9-30H,1-8H3;9-29H,1-8H3 |
| InChIKey | AIVNMTSUHXGDBD-UHFFFAOYSA-N |
| XLogP | 40.06 |
| TPSA | 134.08 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 11 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 165 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2136.80 |
| LogP ≤ 5 | 40.06 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 11 |