| CAS Number | 1246467-58-2 |
| Catalog Number | AG009WD3(AGN-PC-0WQUM1) |
| Chemical Name | PY1 , 3,5-di(pyren-1-yl)pyridine |
| IUPAC Name | 3,5-di(pyren-1-yl)pyridine |
| InChI | InChI=1S/C37H21N/c1-3-22-7-9-26-11-15-30(32-17-13-24(5-1)34(22)36(26)32)28-19-29(21-38-20-28)31-16-12-27-10-8-23-4-2-6-25-14-18-33(31)37(27)35(23)25/h1-21H |
| InChI Key | YNTQHSDEZACXAP-UHFFFAOYSA-N |
| MDL Number | MFCD28387863 |
| Molecular Formula | C37H21N |
| Molecular Weight | 479.5693 |
| SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C5=CC(=CN=C5)C6=C7C=CC8=CC=CC9=C8C7=C(C=C9)C=C6 |
| Synonyms | 3,5-Di(1-pyrenyl)pyridine,
1246467-58-2,
3,5-Di(pyren-1-yl)pyridine,
3,5-Bis(1-pyrenyl)pyridine,
SCHEMBL16335156,
MFCD28387863,
AKOS030529792,
D4931,
3,5-Di-1-pyrenylpyridine,
|
| Complexity | 797 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 479.167g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 38 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 479.582g/mol |
| Monoisotopic Mass | 479.167g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 10.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number