C304H212 — CID 159357464
11,11-dimethyl-2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-9-[3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]benzo[a]fluorene;11,11-dimethyl-9-[3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]benzo[a]fluorene;11,11-dimethyl-2-[4-(10-phenylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene (PubChem CID 159357464) has the molecular formula C304H212 and a molecular weight of 3865.04 g/mol. Its IUPAC name is 11,11-dimethyl-2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-9-[3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]benzo[a]fluorene;11,11-dimethyl-9-[3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]benzo[a]fluorene;11,11-dimethyl-2-[4-(10-phenylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene.
| Compound Name | 11,11-dimethyl-2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-9-[3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]benzo[a]fluorene;11,11-dimethyl-9-[3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]benzo[a]fluorene;11,11-dimethyl-2-[4-(10-phenylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene |
|---|---|
| PubChem CID | 159357464 |
| Molecular Formula | C304H212 |
| Molecular Weight | 3865.04 g/mol |
| Exact Mass | 3861.66 |
| IUPAC Name | 11,11-dimethyl-2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-9-[3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]benzo[a]fluorene;11,11-dimethyl-9-[3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]benzo[a]fluorene;11,11-dimethyl-2-[4-(10-phenylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene |
| SMILES | CC1(C)c2cc(-c3ccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)cc3)ccc2-c2cc3ccccc3cc21.CC1(C)c2cc(-c3ccc(-c4c5ccccc5c(-c5cccc(-c6ccccc6)c5)c5ccccc45)cc3)ccc2-c2cc3ccccc3cc21.CC1(C)c2cc(-c3ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc3)ccc2-c2cc3ccccc3cc21.CC1(C)c2cc(-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)ccc2-c2cc3ccccc3cc21.CC1(C)c2cc(-c3cccc(-c4c5ccccc5c(-c5ccc(-c6ccc7ccccc7c6)cc5)c5ccccc45)c3)ccc2-c2ccc3ccccc3c21.CC1(C)c2cc(-c3cccc(-c4c5ccccc5c(-c5ccc(-c6cccc7ccccc67)cc5)c5ccccc45)c3)ccc2-c2ccc3ccccc3c21 |
| InChI | InChI=1S/2C55H38.C51H36.2C49H34.C45H32/c1-55(2)51-34-40(30-31-45(51)50-32-29-36-14-4-6-19-44(36)54(50)55)39-16-11-17-41(33-39)53-48-22-9-7-20-46(48)52(47-21-8-10-23-49(47)53)38-27-25-37(26-28-38)43-24-12-15-35-13-3-5-18-42(35)43;1-55(2)51-34-42(29-30-45(51)50-31-28-37-13-5-6-17-44(37)54(50)55)40-15-11-16-43(33-40)53-48-20-9-7-18-46(48)52(47-19-8-10-21-49(47)53)38-25-22-36(23-26-38)41-27-24-35-12-3-4-14-39(35)32-41;1-51(2)47-32-39(27-28-41(47)46-30-37-15-6-7-16-38(37)31-48(46)51)34-23-25-35(26-24-34)49-42-19-8-10-21-44(42)50(45-22-11-9-20-43(45)49)40-18-12-17-36(29-40)33-13-4-3-5-14-33;1-49(2)45-30-36(26-27-38(45)44-28-34-13-3-4-14-35(34)29-46(44)49)31-22-24-33(25-23-31)47-40-17-7-9-19-42(40)48(43-20-10-8-18-41(43)47)39-21-11-15-32-12-5-6-16-37(32)39;1-49(2)45-30-37(25-26-39(45)44-28-35-13-5-6-14-36(35)29-46(44)49)32-19-22-33(23-20-32)47-40-15-7-9-17-42(40)48(43-18-10-8-16-41(43)47)38-24-21-31-11-3-4-12-34(31)27-38;1-45(2)41-28-34(24-25-35(41)40-26-32-14-6-7-15-33(32)27-42(40)45)29-20-22-31(23-21-29)44-38-18-10-8-16-36(38)43(30-12-4-3-5-13-30)37-17-9-11-19-39(37)44/h2*3-34H,1-2H3;3-32H,1-2H3;2*3-30H,1-2H3;3-28H,1-2H3 |
| InChIKey | LICKJJGOFSOJNY-UHFFFAOYSA-N |
| XLogP | 84.33 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 21 |
| Heavy Atoms | 304 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3865.04 |
| LogP ≤ 5 | 84.33 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |