| CAS Number | 1207176-84-8 |
| Catalog Number | AG0091IT(AGN-PC-0WQUOK) |
| Chemical Name | 1,3,5-Triazine, 2,4-diphenyl-6-(9,9'-spirobi[9H-fluoren]-2-yl)- |
| IUPAC Name | 2,4-diphenyl-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine |
| InChI | InChI=1S/C40H25N3/c1-3-13-26(14-4-1)37-41-38(27-15-5-2-6-16-27)43-39(42-37)28-23-24-32-31-19-9-12-22-35(31)40(36(32)25-28)33-20-10-7-17-29(33)30-18-8-11-21-34(30)40/h1-25H |
| InChI Key | YMMIMGRBLQBRNC-UHFFFAOYSA-N |
| MDL Number | MFCD30721570 |
| Molecular Formula | C40H25N3 |
| Molecular Weight | 547.6466 |
| SMILES | C1(C2=CC(C3(C4=C(C5=C3C=CC=C5)C=CC=C4)C6=C7C=CC=C6)=C7C=C2)=NC(C8=CC=CC=C8)=NC(C9=CC=CC=C9)=N1 |
| Synonyms | 1207176-84-8,
2,4-diphenyl-6-(9,9'-spirobi[9H-fluoren]-2-yl)-1,3,5-triazine,
2-(9,9'-Spirobi[fluoren]-2-yl)-4,6-diphenyl-1,3,5-triazine,
SCHEMBL132140,
ZINC113186381,
P2512,
1,3,5-Triazine,2,4-diphenyl-6-(9,9'-spirobi[9H-fluoren]-2-yl)-,
YMMIMGRBLQBRNC-UHFFFAOYSA-N,
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| Complexity | 903 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 547.205g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 43 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 547.661g/mol |
| Monoisotopic Mass | 547.205g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 9.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number