| CAS Number | 850352-73-7 |
| Catalog Number | AG00G9JS(AGN-PC-022IDB) |
| Chemical Name | 3-bromo-6,7-dimethoxyquinoline |
| IUPAC Name | 3-bromo-6,7-dimethoxyquinoline |
| InChI | InChI=1S/C11H10BrNO2/c1-14-10-4-7-3-8(12)6-13-9(7)5-11(10)15-2/h3-6H,1-2H3 |
| InChI Key | MJCXPYIMFFMKTK-UHFFFAOYSA-N |
| MDL Number | MFCD29090867 |
| Molecular Formula | C11H10BrNO2 |
| Molecular Weight | 268.1066 |
| SMILES | BrC=1C=NC2=CC(=C(C=C2C1)OC)OC |
| Synonyms | 3-bromo-6,7-dimethoxyquinoline,
850352-73-7,
3-Bromo-6,7-dimethoxy-quinoline,
SCHEMBL8501715,
Quinoline, 3-bromo-6,7-dimethoxy-,
AKOS026745936,
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| Complexity | 215 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 266.989g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.11g/mol |
| Monoisotopic Mass | 266.989g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 31.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
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Certificate of Analysis
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