| CAS Number | 2060040-09-5 |
| Catalog Number | AG01C05L |
| Chemical Name | sodium 4-cyclopropyl-1,3-thiazole-2-carboxylate |
| IUPAC Name | sodium;4-cyclopropyl-1,3-thiazole-2-carboxylate |
| InChI | InChI=1S/C7H7NO2S.Na/c9-7(10)6-8-5(3-11-6)4-1-2-4;/h3-4H,1-2H2,(H,9,10);/q;+1/p-1 |
| InChI Key | YPXNCASSNJLXSQ-UHFFFAOYSA-M |
| MDL Number | MFCD30497831 |
| Molecular Formula | C7H6NNaO2S |
| Molecular Weight | 191.1828 |
| SMILES | [Na+].[O-]C(C1SC=C(C2CC2)N=1)=O |
| Synonyms | sodium 4-cyclopropyl-1,3-thiazole-2-carboxylate,
2060040-09-5,
MFCD30497831,
Z2719319035,
|
| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.002g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.18g/mol |
| Monoisotopic Mass | 191.002g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 81.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number