| CAS Number | 1016508-48-7 |
| Catalog Number | AG019WCD(AGN-PC-0WO0XP) |
| Chemical Name | 2-chloro-6-(2-methylpropoxy)pyrazine |
| IUPAC Name | 2-chloro-6-(2-methylpropoxy)pyrazine |
| InChI | InChI=1S/C8H11ClN2O/c1-6(2)5-12-8-4-10-3-7(9)11-8/h3-4,6H,5H2,1-2H3 |
| InChI Key | SDCKYWPFPKFGLU-UHFFFAOYSA-N |
| MDL Number | MFCD09807594 |
| Molecular Formula | C8H11ClN2O |
| Molecular Weight | 186.6387 |
| SMILES | CC(COC1=NC(Cl)=CN=C1)C |
| Synonyms | 2-chloro-6-(2-methylpropoxy)pyrazine,
2-chloro-6-isobutoxypyrazine,
1016508-48-7,
Pyrazine, 2-chloro-6-(2-methylpropoxy)-,
AC1Q1PTF,
SCHEMBL4443948,
CTK6A9040,
SDCKYWPFPKFGLU-UHFFFAOYSA-N,
ZINC19415948,
AKOS000169128,
NE14485,
EN300-51435,
|
| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.639g/mol |
| Monoisotopic Mass | 186.056g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number