C134H98N2 — CID 162172541
9,9-dimethyl-7-(4-naphthalen-1-ylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine;9,9-dimethyl-7-(4-naphthalen-2-ylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine (PubChem CID 162172541) has the molecular formula C134H98N2 and a molecular weight of 1736.27 g/mol. Its IUPAC name is 9,9-dimethyl-7-(4-naphthalen-1-ylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine;9,9-dimethyl-7-(4-naphthalen-2-ylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine.
| Compound Name | 9,9-dimethyl-7-(4-naphthalen-1-ylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine;9,9-dimethyl-7-(4-naphthalen-2-ylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine |
|---|---|
| PubChem CID | 162172541 |
| Molecular Formula | C134H98N2 |
| Molecular Weight | 1736.27 g/mol |
| Exact Mass | 1734.77 |
| IUPAC Name | 9,9-dimethyl-7-(4-naphthalen-1-ylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine;9,9-dimethyl-7-(4-naphthalen-2-ylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine |
| SMILES | CC1(C)c2cc(-c3ccc(-c4ccc5ccccc5c4)cc3)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)cc21.CC1(C)c2cc(-c3ccc(-c4cccc5ccccc45)cc3)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)cc21 |
| InChI | InChI=1S/2C67H49N/c1-67(2)65-44-57(54-28-30-56(31-29-54)62-19-11-17-55-16-9-10-18-61(55)62)36-42-63(65)64-43-41-60(45-66(64)67)68(58-37-32-52(33-38-58)50-24-20-48(21-25-50)46-12-5-3-6-13-46)59-39-34-53(35-40-59)51-26-22-49(23-27-51)47-14-7-4-8-15-47;1-67(2)65-44-59(56-27-25-55(26-28-56)58-30-29-48-15-9-10-16-57(48)43-58)35-41-63(65)64-42-40-62(45-66(64)67)68(60-36-31-53(32-37-60)51-21-17-49(18-22-51)46-11-5-3-6-12-46)61-38-33-54(34-39-61)52-23-19-50(20-24-52)47-13-7-4-8-14-47/h2*3-45H,1-2H3 |
| InChIKey | ZNZBIBQITRVTHU-UHFFFAOYSA-N |
| XLogP | 37.24 |
| TPSA | 6.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 136 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1736.27 |
| LogP ≤ 5 | 37.24 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |