C262H204O6 — CID 159684564
2,7-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethylanthracen-9-one;2,7-bis(9,9-dimethylfluoren-3-yl)-10,10-dimethylanthracen-9-one;2,7-bis(9,9-dimethylfluoren-4-yl)-10,10-dimethylanthracen-9-one;2,7-bis(2,6-diphenylphenyl)-10,10-dimethylanthracen-9-one;10,10-dimethyl-2,7-dinaphthalen-1-ylanthracen-9-one;10,10-dimethyl-2,7-dinaphthalen-2-ylanthracen-9-one (PubChem CID 159684564) has the molecular formula C262H204O6 and a molecular weight of 3448.51 g/mol. Its IUPAC name is 2,7-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethylanthracen-9-one;2,7-bis(9,9-dimethylfluoren-3-yl)-10,10-dimethylanthracen-9-one;2,7-bis(9,9-dimethylfluoren-4-yl)-10,10-dimethylanthracen-9-one;2,7-bis(2,6-diphenylphenyl)-10,10-dimethylanthracen-9-one;10,10-dimethyl-2,7-dinaphthalen-1-ylanthracen-9-one;10,10-dimethyl-2,7-dinaphthalen-2-ylanthracen-9-one.
| Compound Name | 2,7-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethylanthracen-9-one;2,7-bis(9,9-dimethylfluoren-3-yl)-10,10-dimethylanthracen-9-one;2,7-bis(9,9-dimethylfluoren-4-yl)-10,10-dimethylanthracen-9-one;2,7-bis(2,6-diphenylphenyl)-10,10-dimethylanthracen-9-one;10,10-dimethyl-2,7-dinaphthalen-1-ylanthracen-9-one;10,10-dimethyl-2,7-dinaphthalen-2-ylanthracen-9-one |
|---|---|
| PubChem CID | 159684564 |
| Molecular Formula | C262H204O6 |
| Molecular Weight | 3448.51 g/mol |
| Exact Mass | 3445.57 |
| IUPAC Name | 2,7-bis(9,9-dimethylfluoren-2-yl)-10,10-dimethylanthracen-9-one;2,7-bis(9,9-dimethylfluoren-3-yl)-10,10-dimethylanthracen-9-one;2,7-bis(9,9-dimethylfluoren-4-yl)-10,10-dimethylanthracen-9-one;2,7-bis(2,6-diphenylphenyl)-10,10-dimethylanthracen-9-one;10,10-dimethyl-2,7-dinaphthalen-1-ylanthracen-9-one;10,10-dimethyl-2,7-dinaphthalen-2-ylanthracen-9-one |
| SMILES | CC1(C)c2ccc(-c3c(-c4ccccc4)cccc3-c3ccccc3)cc2C(=O)c2cc(-c3c(-c4ccccc4)cccc3-c3ccccc3)ccc21.CC1(C)c2ccc(-c3ccc4c(c3)-c3ccccc3C4(C)C)cc2C(=O)c2cc(-c3ccc4c(c3)-c3ccccc3C4(C)C)ccc21.CC1(C)c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2C(=O)c2cc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc21.CC1(C)c2ccc(-c3ccc4ccccc4c3)cc2C(=O)c2cc(-c3ccc4ccccc4c3)ccc21.CC1(C)c2ccc(-c3cccc4c3-c3ccccc3C4(C)C)cc2C(=O)c2cc(-c3cccc4c3-c3ccccc3C4(C)C)ccc21.CC1(C)c2ccc(-c3cccc4ccccc34)cc2C(=O)c2cc(-c3cccc4ccccc34)ccc21 |
| InChI | InChI=1S/C52H38O.3C46H38O.2C36H26O/c1-52(2)47-31-29-39(49-41(35-17-7-3-8-18-35)25-15-26-42(49)36-19-9-4-10-20-36)33-45(47)51(53)46-34-40(30-32-48(46)52)50-43(37-21-11-5-12-22-37)27-16-28-44(50)38-23-13-6-14-24-38;1-44(2)37-23-21-27(29-15-11-19-39-41(29)31-13-7-9-17-35(31)45(39,3)4)25-33(37)43(47)34-26-28(22-24-38(34)44)30-16-12-20-40-42(30)32-14-8-10-18-36(32)46(40,5)6;1-44(2)39-21-17-27(29-15-19-33-31-11-7-9-13-37(31)45(3,4)41(33)25-29)23-35(39)43(47)36-24-28(18-22-40(36)44)30-16-20-34-32-12-8-10-14-38(32)46(5,6)42(34)26-30;1-44(2)37-13-9-7-11-31(37)33-23-27(15-19-39(33)44)29-17-21-41-35(25-29)43(47)36-26-30(18-22-42(36)46(41,5)6)28-16-20-40-34(24-28)32-12-8-10-14-38(32)45(40,3)4;1-36(2)33-19-17-25(29-15-7-11-23-9-3-5-13-27(23)29)21-31(33)35(37)32-22-26(18-20-34(32)36)30-16-8-12-24-10-4-6-14-28(24)30;1-36(2)33-17-15-29(27-13-11-23-7-3-5-9-25(23)19-27)21-31(33)35(37)32-22-30(16-18-34(32)36)28-14-12-24-8-4-6-10-26(24)20-28/h3-34H,1-2H3;3*7-26H,1-6H3;2*3-22H,1-2H3 |
| InChIKey | MVPWVXPGHJNAAY-UHFFFAOYSA-N |
| XLogP | 66.46 |
| TPSA | 102.42 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 268 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3448.51 |
| LogP ≤ 5 | 66.46 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |