| CAS Number | 1965304-90-8 |
| Catalog Number | AG01FER6(AGN-PC-3H4A30) |
| Chemical Name | 2-Methyl-3-phenyl-2H-quinoxaline |
| IUPAC Name | 2-methyl-3-phenyl-1,2-dihydroquinoxaline |
| InChI | InChI=1S/C15H14N2/c1-11-15(12-7-3-2-4-8-12)17-14-10-6-5-9-13(14)16-11/h2-11,16H,1H3 |
| InChI Key | NTZQTKGPRPAFNW-UHFFFAOYSA-N |
| MDL Number | MFCD28166200 |
| Molecular Formula | C15H14N2 |
| Molecular Weight | 222.2851 |
| SMILES | CC1Nc2ccccc2N=C1c1ccccc1 |
| Synonyms | 2-Methyl-3-phenyl-2H-quinoxaline,
1965304-90-8,
2-Methyl-3-phenyl-2H-quinoxaline, AldrichCPR,
|
| Complexity | 291 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.291g/mol |
| Monoisotopic Mass | 222.116g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 24.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
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Certificate of Analysis
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