C212H145N3 — CID 159770549
N,N-bis(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-3-amine;N,N-bis(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-4-amine;N-(9,9-diphenylfluoren-4-yl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-4-amine (PubChem CID 159770549) has the molecular formula C212H145N3 and a molecular weight of 2734.51 g/mol. Its IUPAC name is N,N-bis(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-3-amine;N,N-bis(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-4-amine;N-(9,9-diphenylfluoren-4-yl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-4-amine.
| Compound Name | N,N-bis(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-3-amine;N,N-bis(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-4-amine;N-(9,9-diphenylfluoren-4-yl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-4-amine |
|---|---|
| PubChem CID | 159770549 |
| Molecular Formula | C212H145N3 |
| Molecular Weight | 2734.51 g/mol |
| Exact Mass | 2732.14 |
| IUPAC Name | N,N-bis(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-3-amine;N,N-bis(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-4-amine;N-(9,9-diphenylfluoren-4-yl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-4-amine |
| SMILES | c1ccc(-c2ccc(N(c3cccc4c3-c3ccccc3C4(c3ccccc3)c3ccccc3)c3cccc4c3-c3ccccc3C4(c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cccc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3cc(N(c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)ccc32)cc1 |
| InChI | InChI=1S/2C75H51N.C62H43N/c1-7-28-52(29-8-1)73(53-30-9-2-10-31-53)61-43-22-19-40-58(61)70-64(73)46-25-49-67(70)76(68-50-26-47-65-71(68)59-41-20-23-44-62(59)74(65,54-32-11-3-12-33-54)55-34-13-4-14-35-55)69-51-27-48-66-72(69)60-42-21-24-45-63(60)75(66,56-36-15-5-16-37-56)57-38-17-6-18-39-57;1-7-27-52(28-8-1)73(53-29-9-2-10-30-53)63-42-22-19-39-59(63)62-51-58(49-50-66(62)73)76(69-47-25-45-67-71(69)60-40-20-23-43-64(60)74(67,54-31-11-3-12-32-54)55-33-13-4-14-34-55)70-48-26-46-68-72(70)61-41-21-24-44-65(61)75(68,56-35-15-5-16-36-56)57-37-17-6-18-38-57;1-6-22-44(23-7-1)45-40-42-50(43-41-45)63(57-38-20-36-55-59(57)51-32-16-18-34-53(51)61(55,46-24-8-2-9-25-46)47-26-10-3-11-27-47)58-39-21-37-56-60(58)52-33-17-19-35-54(52)62(56,48-28-12-4-13-29-48)49-30-14-5-15-31-49/h2*1-51H;1-43H |
| InChIKey | NGBCLLZUFNHXBK-UHFFFAOYSA-N |
| XLogP | 52.04 |
| TPSA | 9.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 26 |
| Heavy Atoms | 215 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2734.51 |
| LogP ≤ 5 | 52.04 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |