| CAS Number | 1398504-36-3 |
| Catalog Number | AG00HVP3 |
| Chemical Name | Methyl 5-bromo-2-methoxypyrimidine-4-carboxylate |
| IUPAC Name | methyl 5-bromo-2-methoxypyrimidine-4-carboxylate |
| InChI | InChI=1S/C7H7BrN2O3/c1-12-6(11)5-4(8)3-9-7(10-5)13-2/h3H,1-2H3 |
| InChI Key | SSCVAIBESXHRRL-UHFFFAOYSA-N |
| MDL Number | MFCD22574085 |
| Molecular Formula | C7H7BrN2O3 |
| Molecular Weight | 247.0461 |
| SMILES | BrC=1C(=NC(=NC1)OC)C(=O)OC |
| Synonyms | METHYL 5-BROMO-2-METHOXYPYRIMIDINE-4-CARBOXYLATE,
1398504-36-3,
MFCD22574085,
ZINC91692108,
AS-38573,
X-2758,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.964g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.048g/mol |
| Monoisotopic Mass | 245.964g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 61.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number