| CAS Number | 1189107-37-6 |
| Catalog Number | AG00780Y(AGN-PC-0WR1SH) |
| Chemical Name | 4-Bromo-8-chloro-5-methoxyquinoline |
| IUPAC Name | 4-bromo-8-chloro-5-methoxyquinoline |
| InChI | InChI=1S/C10H7BrClNO/c1-14-8-3-2-7(12)10-9(8)6(11)4-5-13-10/h2-5H,1H3 |
| InChI Key | BCCYFKPZAHJIKQ-UHFFFAOYSA-N |
| MDL Number | MFCD12675020 |
| Molecular Formula | C10H7BrClNO |
| Molecular Weight | 272.5257 |
| SMILES | COC1=C2C(Br)=CC=NC2=C(Cl)C=C1 |
| Synonyms | 4-Bromo-8-chloro-5-methoxyquinoline,
1189107-37-6,
CTK8E4916,
DTXSID30670952,
MFCD12675020,
ZINC36075611,
DB-057855,
RT-016975,
FT-0766786,
T6259,
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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