| CAS Number | 1258780-50-5 |
| Catalog Number | AG009Y4Z(AGN-PC-0WNP2F) |
| Chemical Name | 9-Phenyl-3,6-Bis(4-(1-Phenyl-1H-Benzo[D]Imidazol-2-Yl)Phenyl)-9H-Carbazole |
| IUPAC Name | 9-phenyl-3,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole |
| InChI | InChI=1S/C56H37N5/c1-4-14-44(15-5-1)59-51-34-32-42(38-24-28-40(29-25-38)55-57-49-20-10-12-22-53(49)60(55)45-16-6-2-7-17-45)36-47(51)48-37-43(33-35-52(48)59)39-26-30-41(31-27-39)56-58-50-21-11-13-23-54(50)61(56)46-18-8-3-9-19-46/h1-37H |
| InChI Key | CWUOZRFIMAVZLO-UHFFFAOYSA-N |
| MDL Number | MFCD31618148 |
| Molecular Formula | C56H37N5 |
| Molecular Weight | 779.9265 |
| SMILES | C1(=CC=CC=C1)N1C2=CC=C(C=C2C=2C=C(C=CC12)C1=CC=C(C=C1)C1=NC2=C(N1C1=CC=CC=C1)C=CC=C2)C2=CC=C(C=C2)C2=NC1=C(N2C2=CC=CC=C2)C=CC=C1 |
| Synonyms | 1258780-50-5,
9-Phenyl-3,6-bis[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole,
SCHEMBL17523195,
CWUOZRFIMAVZLO-UHFFFAOYSA-N,
P2330,
3,6-Bis[4-(1-phenyl-1H-benzoimidazole-2-yl)phenyl]-9-phenyl-9H-carbazole,
9-Phenyl-3,6-bis[4-(1-phenyl-1H-benzimidazol-2-yl)phenyl]-9H-carbazole,
|
| Complexity | 1300 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 779.305g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 61 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 779.947g/mol |
| Monoisotopic Mass | 779.305g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 40.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 13.9 |
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Certificate of Analysis
Lot Number