| CAS Number | 1189107-33-2 |
| Catalog Number | AG009236(AGN-PC-0WCQZY) |
| Chemical Name | 4-Bromo-6-chloro-8-methoxyquinoline |
| IUPAC Name | 4-bromo-6-chloro-8-methoxyquinoline |
| InChI | InChI=1S/C10H7BrClNO/c1-14-9-5-6(12)4-7-8(11)2-3-13-10(7)9/h2-5H,1H3 |
| InChI Key | MZTOJGRLIYQFOM-UHFFFAOYSA-N |
| MDL Number | MFCD12675014 |
| Molecular Formula | C10H7BrClNO |
| Molecular Weight | 272.5257 |
| SMILES | COc1cc(Cl)cc2c1nccc2Br |
| Synonyms | 4-Bromo-6-chloro-8-methoxyquinoline,
1189107-33-2,
SCHEMBL20292984,
CTK8E4894,
DTXSID10670950,
MFCD12675014,
ZINC36075606,
FCH1374267,
OR309313,
DB-061449,
RT-016941,
FT-0687585,
T6258,
J-003910,
ACN-001359,
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| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.526g/mol |
| Monoisotopic Mass | 270.94g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number