| CAS Number | 103858-47-5 |
| Catalog Number | AG00HA78 |
| Chemical Name | 2-Bromo-4,6-dimethylquinoline |
| IUPAC Name | 2-bromo-4,6-dimethylquinoline |
| InChI | InChI=1S/C11H10BrN/c1-7-3-4-10-9(5-7)8(2)6-11(12)13-10/h3-6H,1-2H3 |
| InChI Key | PVPUBDATKWOMSJ-UHFFFAOYSA-N |
| MDL Number | MFCD21647772 |
| Molecular Formula | C11H10BrN |
| Molecular Weight | 236.1078 |
| SMILES | BrC1=NC2=CC=C(C=C2C(=C1)C)C |
| Synonyms | 2-bromo-4,6-dimethylquinoline,
103858-47-5,
SCHEMBL9724208,
MFCD21647772,
ZINC82788538,
DA-16049,
FT-0766909,
T6124,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.112g/mol |
| Monoisotopic Mass | 235g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
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Certificate of Analysis
Lot Number