C300H210 — CID 159999208
11,11-dimethyl-2-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-(10-phenylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene (PubChem CID 159999208) has the molecular formula C300H210 and a molecular weight of 3814.98 g/mol. Its IUPAC name is 11,11-dimethyl-2-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-(10-phenylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene.
| Compound Name | 11,11-dimethyl-2-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-(10-phenylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene |
|---|---|
| PubChem CID | 159999208 |
| Molecular Formula | C300H210 |
| Molecular Weight | 3814.98 g/mol |
| Exact Mass | 3811.64 |
| IUPAC Name | 11,11-dimethyl-2-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-(10-phenylanthracen-9-yl)phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene;11,11-dimethyl-2-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[b]fluorene |
| SMILES | CC1(C)c2cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6cccc7ccccc67)cc5)c5ccccc45)cc3)ccc2-c2cc3ccccc3cc21.CC1(C)c2cc(-c3cccc(-c4c5ccccc5c(-c5ccc(-c6ccccc6)cc5)c5ccccc45)c3)ccc2-c2cc3ccccc3cc21.CC1(C)c2cc(-c3cccc(-c4c5ccccc5c(-c5ccc6ccccc6c5)c5ccccc45)c3)ccc2-c2cc3ccccc3cc21.CC1(C)c2cc(-c3cccc(-c4c5ccccc5c(-c5cccc(-c6ccccc6)c5)c5ccccc45)c3)ccc2-c2cc3ccccc3cc21.CC1(C)c2cc(-c3cccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)c3)ccc2-c2cc3ccccc3cc21.CC1(C)c2cc(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c3)ccc2-c2cc3ccccc3cc21 |
| InChI | InChI=1S/C55H38.2C51H36.2C49H34.C45H32/c1-55(2)51-34-42(30-31-45(51)50-32-40-13-3-4-14-41(40)33-52(50)55)35-22-26-38(27-23-35)53-46-17-7-9-19-48(46)54(49-20-10-8-18-47(49)53)39-28-24-37(25-29-39)44-21-11-15-36-12-5-6-16-43(36)44;1-51(2)47-32-38(26-27-41(47)46-30-36-16-6-7-17-37(36)31-48(46)51)35-19-13-21-40(29-35)50-44-24-10-8-22-42(44)49(43-23-9-11-25-45(43)50)39-20-12-18-34(28-39)33-14-4-3-5-15-33;1-51(2)47-32-39(27-28-41(47)46-30-37-15-6-7-16-38(37)31-48(46)51)36-17-12-18-40(29-36)50-44-21-10-8-19-42(44)49(43-20-9-11-22-45(43)50)35-25-23-34(24-26-35)33-13-4-3-5-14-33;1-49(2)45-30-35(25-26-38(45)44-28-33-14-3-4-15-34(33)29-46(44)49)32-17-11-18-36(27-32)47-40-20-7-9-22-42(40)48(43-23-10-8-21-41(43)47)39-24-12-16-31-13-5-6-19-37(31)39;1-49(2)45-30-36(24-25-39(45)44-28-34-14-5-6-15-35(34)29-46(44)49)33-16-11-17-37(27-33)47-40-18-7-9-20-42(40)48(43-21-10-8-19-41(43)47)38-23-22-31-12-3-4-13-32(31)26-38;1-45(2)41-28-33(23-24-35(41)40-26-31-15-6-7-16-32(31)27-42(40)45)30-17-12-18-34(25-30)44-38-21-10-8-19-36(38)43(29-13-4-3-5-14-29)37-20-9-11-22-39(37)44/h3-34H,1-2H3;2*3-32H,1-2H3;2*3-30H,1-2H3;3-28H,1-2H3 |
| InChIKey | OHYFWEPSSLNEBI-UHFFFAOYSA-N |
| XLogP | 83.18 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 21 |
| Heavy Atoms | 300 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3814.98 |
| LogP ≤ 5 | 83.18 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |