| CAS Number | 1210642-96-8 |
| Catalog Number | AG0093AG |
| Chemical Name | 4-Amino-3-bromo-8-methoxyquinoline |
| IUPAC Name | 3-bromo-8-methoxyquinolin-4-amine |
| InChI | InChI=1S/C10H9BrN2O/c1-14-8-4-2-3-6-9(12)7(11)5-13-10(6)8/h2-5H,1H3,(H2,12,13) |
| InChI Key | YJFNXCMCFQYSLD-UHFFFAOYSA-N |
| MDL Number | MFCD13619788 |
| Molecular Formula | C10H9BrN2O |
| Molecular Weight | 253.0953 |
| SMILES | COc1cccc2c1ncc(c2N)Br |
| Synonyms | 4-Amino-3-bromo-8-methoxyquinoline,
1210642-96-8,
3-bromo-8-methoxyquinolin-4-amine,
SCHEMBL435849,
DTXSID40672740,
MFCD13619788,
ZINC41702211,
FCH1383585,
OR309339,
T6302,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.099g/mol |
| Monoisotopic Mass | 251.99g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number