| CAS Number | 1280786-78-8 |
| Catalog Number | AG000XRK(AGN-PC-0WNQ33) |
| Chemical Name | 3-Bromo-2-methyl-6-propoxypyridine |
| IUPAC Name | 3-bromo-2-methyl-6-propoxypyridine |
| InChI | InChI=1S/C9H12BrNO/c1-3-6-12-9-5-4-8(10)7(2)11-9/h4-5H,3,6H2,1-2H3 |
| InChI Key | LUGOFOMTYGNWHQ-UHFFFAOYSA-N |
| MDL Number | MFCD18783193 |
| Molecular Formula | C9H12BrNO |
| Molecular Weight | 230.1017 |
| SMILES | Cc1nc(OCCC)ccc1Br |
| Synonyms | 3-BROMO-2-METHYL-6-PROPOXYPYRIDINE,
1280786-78-8,
ACMC-209be2,
SCHEMBL15918541,
CTK8A9975,
DTXSID30682459,
ANW-19032,
MFCD18783193,
ZINC65337530,
AKOS015892001,
Pyridine, 3-bromo-2-methyl-6-propoxy-,
CJ-21080,
AJ-115210,
TC-107777,
ST24022720,
Z9404,
A-3346,
I02-3147,
C9H12BrNO,
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| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.105g/mol |
| Monoisotopic Mass | 229.01g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number