| CAS Number | 1189106-52-2 |
| Catalog Number | AG0080S2(AGN-PC-0WR1YA) |
| Chemical Name | 4-Amino-7-bromo-8-methylquinoline |
| IUPAC Name | 7-bromo-8-methylquinolin-4-amine |
| InChI | InChI=1S/C10H9BrN2/c1-6-8(11)3-2-7-9(12)4-5-13-10(6)7/h2-5H,1H3,(H2,12,13) |
| InChI Key | BEYAXBLNXNFZSL-UHFFFAOYSA-N |
| MDL Number | MFCD12674989 |
| Molecular Formula | C10H9BrN2 |
| Molecular Weight | 237.0959 |
| SMILES | Brc1ccc2c(c1C)nccc2N |
| Synonyms | 4-Amino-7-bromo-8-methylquinoline,
1189106-52-2,
7-Bromo-8-methylquinolin-4-amine,
SCHEMBL438506,
CTK8E4811,
DTXSID70670931,
MFCD12674989,
ZINC36075584,
AKOS025394218,
RT-016872,
T6247,
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| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.1g/mol |
| Monoisotopic Mass | 235.995g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number