| CAS Number | 180530-01-2 |
| Catalog Number | AG00AQJG(AGN-PC-0CTQ9D) |
| Chemical Name | N-(5-bromopyrimidin-2-yl)-N-methylacetamide |
| IUPAC Name | N-(5-bromopyrimidin-2-yl)-N-methylacetamide |
| InChI | InChI=1S/C7H8BrN3O/c1-5(12)11(2)7-9-3-6(8)4-10-7/h3-4H,1-2H3 |
| InChI Key | HHXBORNQIJORQO-UHFFFAOYSA-N |
| MDL Number | MFCD23135958 |
| Molecular Formula | C7H8BrN3O |
| Molecular Weight | 230.0619 |
| SMILES | CN(c1ncc(cn1)Br)C(=O)C |
| Synonyms | N-(5-bromopyrimidin-2-yl)-N-methylacetamide,
180530-01-2,
SCHEMBL568378,
HHXBORNQIJORQO-UHFFFAOYSA-N,
ZINC95495980,
V3895,
K-5515,
N-(5-bromo-pyrimidin-2-yl)-N-methyl-acetamide,
Acetamide, N-(5-bromo-2-pyrimidinyl)-N-methyl-,
C7H8BrN3O,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.065g/mol |
| Monoisotopic Mass | 228.985g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number