| CAS Number | 1262860-62-7 |
| Catalog Number | AG00HRFU(AGN-PC-0WR3BH) |
| Chemical Name | Methyl 5-chloro-3-methylpyrazine-2-carboxylate |
| IUPAC Name | methyl 5-chloro-3-methylpyrazine-2-carboxylate |
| InChI | InChI=1S/C7H7ClN2O2/c1-4-6(7(11)12-2)9-3-5(8)10-4/h3H,1-2H3 |
| InChI Key | VDLBONRRWGRXKW-UHFFFAOYSA-N |
| MDL Number | MFCD22548380 |
| Molecular Formula | C7H7ClN2O2 |
| Molecular Weight | 186.5957 |
| SMILES | O=C(C1=NC=C(Cl)N=C1C)OC |
| Synonyms | METHYL 5-CHLORO-3-METHYLPYRAZINE-2-CARBOXYLATE,
1262860-62-7,
SCHEMBL361753,
VDLBONRRWGRXKW-UHFFFAOYSA-N,
AKOS027321561,
AB85680,
2-Pyrazinecarboxylicacid,5-chloro-3-methyl-,methylester,
2-Pyrazinecarboxylic acid, 5-chloro-3-methyl-, methyl ester,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.595g/mol |
| Monoisotopic Mass | 186.02g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number