| CAS Number | 1256810-64-6 |
| Catalog Number | AG000OEO(AGN-PC-0JF3UX) |
| Chemical Name | Pyridine, 2-bromo-4-chloro-5-methoxy- |
| IUPAC Name | 2-bromo-4-chloro-5-methoxypyridine |
| InChI | InChI=1S/C6H5BrClNO/c1-10-5-3-9-6(7)2-4(5)8/h2-3H,1H3 |
| InChI Key | NATSPHDWPVWHLE-UHFFFAOYSA-N |
| MDL Number | MFCD18257593 |
| Molecular Formula | C6H5BrClNO |
| Molecular Weight | 222.4670 |
| SMILES | COC1=CN=C(Br)C=C1Cl |
| Synonyms | 2-Bromo-4-chloro-5-methoxypyridine,
1256810-64-6,
Pyridine, 2-bromo-4-chloro-5-methoxy-,
SCHEMBL19615024,
DTXSID90855703,
4837AA,
MFCD18257593,
ZINC85210487,
FCH1365694,
AK109990,
AS-47901,
AJ-126607,
AX8225294,
C6H5BrClNO,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.924g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.466g/mol |
| Monoisotopic Mass | 220.924g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number