| CAS Number | 58549-95-4 |
| Catalog Number | AG01EHRM(AGN-PC-0NI8NH) |
| Chemical Name | 2,5-bis(chloromethyl)pyrazine |
| IUPAC Name | 2,5-bis(chloromethyl)pyrazine |
| InChI | InChI=1S/C6H6Cl2N2/c7-1-5-3-10-6(2-8)4-9-5/h3-4H,1-2H2 |
| InChI Key | OUIUTOQNQNHRKC-UHFFFAOYSA-N |
| MDL Number | MFCD15144495 |
| Molecular Formula | C6H6Cl2N2 |
| Molecular Weight | 177.0312 |
| SMILES | ClCC1=NC=C(CCl)N=C1 |
| Synonyms | 2,5-bis(chloromethyl)-Pyrazine,
58549-95-4,
Pyrazine, 2,5-bis(chloromethyl)-,
2,5-Bis(chloromethyl)pyrazine,
SCHEMBL7811855,
|
| Complexity | 87.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.991g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.028g/mol |
| Monoisotopic Mass | 175.991g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number