| CAS Number | 1909336-77-1 |
| Catalog Number | AG01C57Q |
| Chemical Name | 4-(chloromethyl)-2-(5-methylfuran-2-yl)-1,3-thiazole hydrochloride |
| IUPAC Name | 4-(chloromethyl)-2-(5-methylfuran-2-yl)-1,3-thiazole;hydrochloride |
| InChI | InChI=1S/C9H8ClNOS.ClH/c1-6-2-3-8(12-6)9-11-7(4-10)5-13-9;/h2-3,5H,4H2,1H3;1H |
| InChI Key | QECNUQAGJXABSU-UHFFFAOYSA-N |
| MDL Number | MFCD29763331 |
| Molecular Formula | C9H9Cl2NOS |
| Molecular Weight | 250.1449 |
| SMILES | Cl.CC1OC(C2SC=C(CCl)N=2)=CC=1 |
| Synonyms | 4-(chloromethyl)-2-(5-methylfuran-2-yl)-1,3-thiazole hydrochloride,
1909336-77-1,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.978g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.137g/mol |
| Monoisotopic Mass | 248.978g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 54.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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