C333H230N6O6 — CID 160965633
N,N-bis(4-dibenzofuran-4-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 160965633) has the molecular formula C333H230N6O6 and a molecular weight of 4411.54 g/mol. Its IUPAC name is N,N-bis(4-dibenzofuran-4-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine.
| Compound Name | N,N-bis(4-dibenzofuran-4-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine |
|---|---|
| PubChem CID | 160965633 |
| Molecular Formula | C333H230N6O6 |
| Molecular Weight | 4411.54 g/mol |
| Exact Mass | 4407.79 |
| IUPAC Name | N,N-bis(4-dibenzofuran-4-ylphenyl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)dibenzofuran-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4oc5ccccc5c4c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3cccc4c3oc3ccccc34)cc21.c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)cc21 |
| InChI | InChI=1S/C61H37NO2.C58H39NO.C58H41NO.2C52H37NO.C52H39N/c1-6-22-53-45(13-1)46-14-2-7-23-54(46)61(53)55-24-8-3-15-47(55)48-36-35-42(37-56(48)61)62(40-31-27-38(28-32-40)43-18-11-20-51-49-16-4-9-25-57(49)63-59(43)51)41-33-29-39(30-34-41)44-19-12-21-52-50-17-5-10-26-58(50)64-60(44)52;1-57(2)49-21-8-3-14-41(49)45-32-30-38(34-53(45)57)59(37-28-26-36(27-29-37)40-19-13-20-48-47-18-7-12-25-55(47)60-56(40)48)39-31-33-46-44-17-6-11-24-52(44)58(54(46)35-39)50-22-9-4-15-42(50)43-16-5-10-23-51(43)58;1-57(2)51-25-12-9-20-45(51)47-34-32-42(36-53(47)57)59(41-30-28-38(29-31-41)44-23-15-24-50-49-22-11-14-27-55(49)60-56(44)50)43-33-35-48-46-21-10-13-26-52(46)58(54(48)37-43,39-16-5-3-6-17-39)40-18-7-4-8-19-40;1-51(2)44-24-12-9-20-38(44)40-30-28-36(32-46(40)51)53(48-26-15-23-43-42-22-11-14-27-49(42)54-50(43)48)37-29-31-41-39-21-10-13-25-45(39)52(47(41)33-37,34-16-5-3-6-17-34)35-18-7-4-8-19-35;1-51(2)45-22-12-9-19-39(45)41-28-25-37(32-47(41)51)53(36-27-30-50-44(31-36)43-21-11-14-24-49(43)54-50)38-26-29-42-40-20-10-13-23-46(40)52(48(42)33-38,34-15-5-3-6-16-34)35-17-7-4-8-18-35;1-51(2)47-24-14-12-22-43(47)45-32-30-41(34-49(45)51)53(40-28-26-37(27-29-40)36-16-6-3-7-17-36)42-31-33-46-44-23-13-15-25-48(44)52(50(46)35-42,38-18-8-4-9-19-38)39-20-10-5-11-21-39/h1-37H;3-35H,1-2H3;3-37H,1-2H3;2*3-33H,1-2H3;3-35H,1-2H3 |
| InChIKey | SXOUPVQZFAUUED-UHFFFAOYSA-N |
| XLogP | 88.34 |
| TPSA | 98.28 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 31 |
| Heavy Atoms | 345 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4411.54 |
| LogP ≤ 5 | 88.34 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |