| CAS Number | 52606-07-2 |
| Catalog Number | AG00DBA9(AGN-PC-022IEL) |
| Chemical Name | Pyridine, 5-bromo-2,4-dimethoxy- |
| IUPAC Name | 5-bromo-2,4-dimethoxypyridine |
| InChI | InChI=1S/C7H8BrNO2/c1-10-6-3-7(11-2)9-4-5(6)8/h3-4H,1-2H3 |
| InChI Key | IRLDCGSNDXFFQH-UHFFFAOYSA-N |
| MDL Number | MFCD14705145 |
| Molecular Formula | C7H8BrNO2 |
| Molecular Weight | 218.0479 |
| SMILES | O(C)c1cc(OC)ncc1Br |
| Synonyms | 5-bromo-2,4-dimethoxypyridine,
52606-07-2,
SCHEMBL3573917,
CTK4J6175,
DTXSID90596285,
IRLDCGSNDXFFQH-UHFFFAOYSA-N,
CS-D0193,
Pyridine, 5-bromo-2,4-dimethoxy-,
MFCD14705145,
ZINC71864169,
AKOS024219997,
AB70587,
FCH1387665,
AK205213,
AS-30951,
AB0071283,
FT-0698530,
W-4694,
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| Complexity | 123 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.05g/mol |
| Monoisotopic Mass | 216.974g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 31.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number