C132H120 — CID 158427752
1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene (PubChem CID 158427752) has the molecular formula C132H120 and a molecular weight of 1706.41 g/mol. Its IUPAC name is 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene.
| Compound Name | 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene |
|---|---|
| PubChem CID | 158427752 |
| Molecular Formula | C132H120 |
| Molecular Weight | 1706.41 g/mol |
| Exact Mass | 1704.94 |
| IUPAC Name | 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene |
| SMILES | Cc1cc(-c2ccccc2)cc2c1-c1ccccc1C2(C)C.Cc1ccc(-c2ccccc2)c2c1C(C)(C)c1ccccc1-2.Cc1ccc2c(c1)-c1ccc(-c3ccccc3)cc1C2(C)C.Cc1ccc2c(c1)C(C)(C)c1cc(-c3ccccc3)ccc1-2.Cc1cccc2c1-c1ccc(-c3ccccc3)cc1C2(C)C.Cc1cccc2c1C(C)(C)c1cc(-c3ccccc3)ccc1-2 |
| InChI | InChI=1S/6C22H20/c1-15-8-7-11-19-21(15)18-13-12-17(14-20(18)22(19,2)3)16-9-5-4-6-10-16;1-15-8-7-11-19-18-13-12-17(16-9-5-4-6-10-16)14-20(18)22(2,3)21(15)19;1-15-13-17(16-9-5-4-6-10-16)14-20-21(15)18-11-7-8-12-19(18)22(20,2)3;1-15-13-14-17(16-9-5-4-6-10-16)20-18-11-7-8-12-19(18)22(2,3)21(15)20;1-15-9-12-20-19(13-15)18-11-10-17(14-21(18)22(20,2)3)16-7-5-4-6-8-16;1-15-9-11-18-19-12-10-17(16-7-5-4-6-8-16)14-21(19)22(2,3)20(18)13-15/h6*4-14H,1-3H3 |
| InChIKey | HBGNXCMNQFIFEZ-UHFFFAOYSA-N |
| XLogP | 35.81 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 6 |
| Heavy Atoms | 132 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1706.41 |
| LogP ≤ 5 | 35.81 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |