| CAS Number | 1187385-61-0 |
| Catalog Number | AG007PRB(AGN-PC-0WNQ95) |
| Chemical Name | 6-Bromo-2-ethoxy-4-methylquinoline |
| IUPAC Name | 6-bromo-2-ethoxy-4-methylquinoline |
| InChI | InChI=1S/C12H12BrNO/c1-3-15-12-6-8(2)10-7-9(13)4-5-11(10)14-12/h4-7H,3H2,1-2H3 |
| InChI Key | RISONBQHKATDEZ-UHFFFAOYSA-N |
| MDL Number | MFCD12756431 |
| Molecular Formula | C12H12BrNO |
| Molecular Weight | 266.1338 |
| SMILES | CCOc1cc(C)c2c(n1)ccc(c2)Br |
| Synonyms | 6-BROMO-2-ETHOXY-4-METHYLQUINOLINE,
1187385-61-0,
ACMC-2099y8,
CTK4B0816,
DTXSID70674994,
ANW-17166,
MFCD12756431,
ZINC38537434,
AKOS015834565,
AJ-96123,
CJ-19463,
AX8231268,
TR-034231,
ST24024272,
Z7946,
A-5255,
I08-576,
C12H12BrNO,
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| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.138g/mol |
| Monoisotopic Mass | 265.01g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number