| CAS Number | 1172616-32-8 |
| Catalog Number | AG018B9D(AGN-PC-0WBQ51) |
| Chemical Name | 2-bromo-7-methyl-1,8-naphthyridine |
| IUPAC Name | 2-bromo-7-methyl-1,8-naphthyridine |
| InChI | InChI=1S/C9H7BrN2/c1-6-2-3-7-4-5-8(10)12-9(7)11-6/h2-5H,1H3 |
| InChI Key | INKMNSPEIMOGPE-UHFFFAOYSA-N |
| MDL Number | MFCD14705079 |
| Molecular Formula | C9H7BrN2 |
| Molecular Weight | 223.0693 |
| SMILES | CC1=NC2=C(C=CC(=N2)Br)C=C1 |
| Synonyms | 2-bromo-7-methyl-1,8-naphthyridine,
1172616-32-8,
ZINC95532019,
AKOS015997606,
W-4632,
F1957-0148,
|
| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.073g/mol |
| Monoisotopic Mass | 221.979g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number