| CAS Number | 62019-55-0 |
| Catalog Number | AG00IAYM(AGN-PC-0NIM42) |
| Chemical Name | dichloro-1,3-thiazole-2-carboxylic acid |
| IUPAC Name | 4,5-dichloro-1,3-thiazole-2-carboxylic acid |
| InChI | InChI=1S/C4HCl2NO2S/c5-1-2(6)10-3(7-1)4(8)9/h(H,8,9) |
| InChI Key | GEMRCIPPTRQSQV-UHFFFAOYSA-N |
| MDL Number | MFCD18451956 |
| Molecular Formula | C4HCl2NO2S |
| Molecular Weight | 198.0272 |
| SMILES | OC(C1SC(Cl)=C(Cl)N=1)=O |
| Synonyms | 4,5-Dichlorothiazole-2-carboxylic acid,
62019-55-0,
2-Thiazolecarboxylic acid, 4,5-dichloro-,
CTK2C8680,
DTXSID10490892,
FCH900987,
ZINC39208385,
AKOS006322701,
4,5-Dichloro-2-thiazolecarboxylic acid,
AJ-99068,
AX8284205,
4,5-Dichloro-1,3-thiazole-2-carboxylic acid,
EN300-188951,
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| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.911g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.017g/mol |
| Monoisotopic Mass | 196.911g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 78.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number