| CAS Number | 1248609-64-4 |
| Catalog Number | AG01BVRS |
| Chemical Name | 2-chloro-3-propoxypyrazine |
| IUPAC Name | 2-chloro-3-propoxypyrazine |
| InChI | InChI=1S/C7H9ClN2O/c1-2-5-11-7-6(8)9-3-4-10-7/h3-4H,2,5H2,1H3 |
| InChI Key | RJNVABIKMZSGDE-UHFFFAOYSA-N |
| MDL Number | MFCD16079708 |
| Molecular Formula | C7H9ClN2O |
| Molecular Weight | 172.6122 |
| SMILES | CCCOC1=C(Cl)N=CC=N1 |
| Synonyms | 2-chloro-3-propoxypyrazine,
1248609-64-4,
ZINC43536707,
AKOS010966814,
|
| Complexity | 113 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.612g/mol |
| Monoisotopic Mass | 172.04g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number