| CAS Number | 1041542-35-1 |
| Catalog Number | AG01B877(AGN-PC-0WC57H) |
| Chemical Name | 5-Bromo-N-(pyridin-2-ylmethyl)pyridin-2-amine |
| IUPAC Name | 5-bromo-N-(pyridin-2-ylmethyl)pyridin-2-amine |
| InChI | InChI=1S/C11H10BrN3/c12-9-4-5-11(14-7-9)15-8-10-3-1-2-6-13-10/h1-7H,8H2,(H,14,15) |
| InChI Key | PRHOYRJQWUQGMY-UHFFFAOYSA-N |
| MDL Number | MFCD11122322 |
| Molecular Formula | C11H10BrN3 |
| Molecular Weight | 264.1212 |
| SMILES | BrC1=CN=C(NCC2=NC=CC=C2)C=C1 |
| Synonyms | 5-bromo-N-(pyridin-2-ylmethyl)pyridin-2-amine,
1041542-35-1,
5-BROMO-N-(2-PYRIDINYLMETHYL)-2-PYRIDINAMINE,
CTK5I7778,
ZINC21508606,
AKOS009229517,
AJ-78584,
RT-001471,
5-bromo-N-[(pyridin-2-yl)methyl]pyridin-2-amine,
4-Methoxypropiophenone,
121-97-1,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.126g/mol |
| Monoisotopic Mass | 263.006g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 37.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
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Certificate of Analysis
Lot Number