C132H120 — CID 157253194
9,9-dimethyl-1-(2-methylphenyl)fluorene;9,9-dimethyl-1-(3-methylphenyl)fluorene;9,9-dimethyl-3-(2-methylphenyl)fluorene;9,9-dimethyl-3-(3-methylphenyl)fluorene;9,9-dimethyl-3-(4-methylphenyl)fluorene;3,9,9-trimethyl-4-phenylfluorene (PubChem CID 157253194) has the molecular formula C132H120 and a molecular weight of 1706.41 g/mol. Its IUPAC name is 9,9-dimethyl-1-(2-methylphenyl)fluorene;9,9-dimethyl-1-(3-methylphenyl)fluorene;9,9-dimethyl-3-(2-methylphenyl)fluorene;9,9-dimethyl-3-(3-methylphenyl)fluorene;9,9-dimethyl-3-(4-methylphenyl)fluorene;3,9,9-trimethyl-4-phenylfluorene.
| Compound Name | 9,9-dimethyl-1-(2-methylphenyl)fluorene;9,9-dimethyl-1-(3-methylphenyl)fluorene;9,9-dimethyl-3-(2-methylphenyl)fluorene;9,9-dimethyl-3-(3-methylphenyl)fluorene;9,9-dimethyl-3-(4-methylphenyl)fluorene;3,9,9-trimethyl-4-phenylfluorene |
|---|---|
| PubChem CID | 157253194 |
| Molecular Formula | C132H120 |
| Molecular Weight | 1706.41 g/mol |
| Exact Mass | 1704.94 |
| IUPAC Name | 9,9-dimethyl-1-(2-methylphenyl)fluorene;9,9-dimethyl-1-(3-methylphenyl)fluorene;9,9-dimethyl-3-(2-methylphenyl)fluorene;9,9-dimethyl-3-(3-methylphenyl)fluorene;9,9-dimethyl-3-(4-methylphenyl)fluorene;3,9,9-trimethyl-4-phenylfluorene |
| SMILES | Cc1ccc(-c2ccc3c(c2)-c2ccccc2C3(C)C)cc1.Cc1ccc2c(c1-c1ccccc1)-c1ccccc1C2(C)C.Cc1cccc(-c2ccc3c(c2)-c2ccccc2C3(C)C)c1.Cc1cccc(-c2cccc3c2C(C)(C)c2ccccc2-3)c1.Cc1ccccc1-c1ccc2c(c1)-c1ccccc1C2(C)C.Cc1ccccc1-c1cccc2c1C(C)(C)c1ccccc1-2 |
| InChI | InChI=1S/6C22H20/c1-15-8-6-9-16(14-15)17-11-7-12-19-18-10-4-5-13-20(18)22(2,3)21(17)19;1-15-9-4-5-10-16(15)18-12-8-13-19-17-11-6-7-14-20(17)22(2,3)21(18)19;1-15-7-6-8-16(13-15)17-11-12-21-19(14-17)18-9-4-5-10-20(18)22(21,2)3;1-15-8-4-5-9-17(15)16-12-13-21-19(14-16)18-10-6-7-11-20(18)22(21,2)3;1-15-13-14-19-21(20(15)16-9-5-4-6-10-16)17-11-7-8-12-18(17)22(19,2)3;1-15-8-10-16(11-9-15)17-12-13-21-19(14-17)18-6-4-5-7-20(18)22(21,2)3/h6*4-14H,1-3H3 |
| InChIKey | AWOOUDBFZQPSMV-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 |