| CAS Number | 61655-74-1 |
| Catalog Number | AG00EJRY(AGN-PC-02S3Z0) |
| Chemical Name | 2-Chloro-6-(methylsulfanyl)pyrazine |
| IUPAC Name | 2-chloro-6-methylsulfanylpyrazine |
| InChI | InChI=1S/C5H5ClN2S/c1-9-5-3-7-2-4(6)8-5/h2-3H,1H3 |
| InChI Key | RSJYLKXSYOTPHB-UHFFFAOYSA-N |
| MDL Number | MFCD12823717 |
| Molecular Formula | C5H5ClN2S |
| Molecular Weight | 160.6246 |
| SMILES | CSC1=NC(Cl)=CN=C1 |
| Synonyms | 2-chloro-6-(methylsulfanyl)pyrazine,
61655-74-1,
2-chloro-6-(methylthio)pyrazine,
Pyrazine, 2-chloro-6-(methylthio)-,
2-chloro-6-methylthiopyrazine,
SCHEMBL11601018,
CTK2D5367,
DTXSID40606045,
RSJYLKXSYOTPHB-UHFFFAOYSA-N,
ZINC38063778,
AKOS010253151,
NE36380,
FT-0705157,
|
| Complexity | 91 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.986g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 160.619g/mol |
| Monoisotopic Mass | 159.986g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number