| CAS Number | 84539-38-8 |
| Catalog Number | AG00G85S(AGN-PC-0US2Z8) |
| Chemical Name | 3-bromo-N-methylpyridin-4-amine |
| IUPAC Name | 3-bromo-N-methylpyridin-4-amine |
| InChI | InChI=1S/C6H7BrN2/c1-8-6-2-3-9-4-5(6)7/h2-4H,1H3,(H,8,9) |
| InChI Key | CDKSEZAZZNDVCY-UHFFFAOYSA-N |
| MDL Number | MFCD07786687 |
| Molecular Formula | C6H7BrN2 |
| Molecular Weight | 187.0372 |
| SMILES | CNC1=C(Br)C=NC=C1 |
| Synonyms | 3-Bromo-N-methylpyridin-4-amine,
84539-38-8,
(3-Bromo-pyridin-4-yl)-methyl-amine,
SCHEMBL6871548,
CDKSEZAZZNDVCY-UHFFFAOYSA-N,
N-Methyl-3-bromopyridine-4-amine,
4-Pyridinamine, 3-bromo-N-methyl-,
2221AJ,
MFCD07786687,
ZINC39120796,
AKOS006285692,
NE63066,
4-Pyridinamine,3-bromo-N-methyl-(9CI),
4CH-000181,
ST24041966,
Z2678251268,
C6H7BrN2,
4-Pyridinamine, 3-bromo-N-methyl- (9CI),
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| Complexity | 87.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.04g/mol |
| Monoisotopic Mass | 185.979g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number