C180H135N15 — CID 161026217
bis(2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine);2-[3-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine (PubChem CID 161026217) has the molecular formula C180H135N15 and a molecular weight of 2508.16 g/mol. Its IUPAC name is bis(2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine);2-[3-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine.
| Compound Name | bis(2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine);2-[3-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine |
|---|---|
| PubChem CID | 161026217 |
| Molecular Formula | C180H135N15 |
| Molecular Weight | 2508.16 g/mol |
| Exact Mass | 2506.10 |
| IUPAC Name | bis(2-[3-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine);2-[3-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(9,9-dimethylfluoren-3-yl)phenyl]-4,6-diphenyl-1,3,5-triazine |
| SMILES | CC1(C)c2ccccc2-c2cc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)ccc21.CC1(C)c2ccccc2-c2cc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)ccc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cc21 |
| InChI | InChI=1S/5C36H27N3/c1-36(2)31-19-10-9-18-29(31)30-23-27(20-21-32(30)36)26-16-11-17-28(22-26)35-38-33(24-12-5-3-6-13-24)37-34(39-35)25-14-7-4-8-15-25;2*1-36(2)31-19-10-9-18-29(31)30-21-20-27(23-32(30)36)26-16-11-17-28(22-26)35-38-33(24-12-5-3-6-13-24)37-34(39-35)25-14-7-4-8-15-25;1-36(2)31-16-10-9-15-29(31)30-23-28(21-22-32(30)36)24-17-19-27(20-18-24)35-38-33(25-11-5-3-6-12-25)37-34(39-35)26-13-7-4-8-14-26;1-36(2)31-16-10-9-15-29(31)30-22-21-28(23-32(30)36)24-17-19-27(20-18-24)35-38-33(25-11-5-3-6-12-25)37-34(39-35)26-13-7-4-8-14-26/h5*3-23H,1-2H3 |
| InChIKey | TYZWNZXWZNUQTM-UHFFFAOYSA-N |
| XLogP | 44.23 |
| TPSA | 193.35 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 195 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2508.16 |
| LogP ≤ 5 | 44.23 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |