| CAS Number | 1210155-66-0 |
| Catalog Number | AG019WZX(AGN-PC-0WOV2H) |
| Chemical Name | 2-(2-Ethyl-1,3-thiazol-4-yl)acetonitrile |
| IUPAC Name | 2-(2-ethyl-1,3-thiazol-4-yl)acetonitrile |
| InChI | InChI=1S/C7H8N2S/c1-2-7-9-6(3-4-8)5-10-7/h5H,2-3H2,1H3 |
| InChI Key | UUMUGPFHNVGYFH-UHFFFAOYSA-N |
| MDL Number | MFCD13195921 |
| Molecular Formula | C7H8N2S |
| Molecular Weight | 152.2168 |
| SMILES | CCC1SC=C(CC#N)N=1 |
| Synonyms | 2-(2-ethyl-1,3-thiazol-4-yl)acetonitrile,
1210155-66-0,
AC1Q2U4N,
SCHEMBL16810688,
CTK6D2603,
STL453428,
ZINC38342210,
AKOS010295225,
MCULE-3944886019,
NE29967,
(2-ethyl-1,3-thiazol-4-yl)acetonitrile,
EN300-53650,
Z818727252,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.215g/mol |
| Monoisotopic Mass | 152.041g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 64.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number