| CAS Number | 1402666-95-8 |
| Catalog Number | AG019EXD(AGN-PC-0WG3P1) |
| Chemical Name | 4-Bromo-2,5-dimethoxypyridine |
| IUPAC Name | 4-bromo-2,5-dimethoxypyridine |
| InChI | InChI=1S/C7H8BrNO2/c1-10-6-4-9-7(11-2)3-5(6)8/h3-4H,1-2H3 |
| InChI Key | UAMAUBNZVNEDQB-UHFFFAOYSA-N |
| MDL Number | MFCD28969395 |
| Molecular Formula | C7H8BrNO2 |
| Molecular Weight | 218.0479 |
| SMILES | COc1ncc(c(c1)Br)OC |
| Synonyms | 4-BROMO-2,5-DIMETHOXYPYRIDINE,
1402666-95-8,
SCHEMBL16114985,
UAMAUBNZVNEDQB-UHFFFAOYSA-N,
MFCD28969395,
ZINC215570017,
4-bromo-2,5-dimethoxypyridine(WXC06648),
CS-0038719,
|
| 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