IUPAC Name: | methyl 4-aminothiophene-3-carboxylate;hydrochloride |
Description: | Methyl 4-Aminothiophene-3-carboxylate Hydrochloride (CAS# 39978-14-8) is used as a reagent in the synthesis of benzisothiazolylpiperazinylbutyl heterocyclic carboxamide antipsychotics. Methyl 4-Aminothiophene-3-carboxylate Hydrochloride is also used as the starting material in the synthesis of 1H-Thieno[3,4-d]pyrimidine-2,4-dione (T344325) which is an analog of thieno[3,4-d]pyrimidine and can serve as a fluorescent probe sensing mismatched pairs. |
Molecular Weight: | 193.65 |
Molecular Formula: | C6H8ClNO2S |
Canonical SMILES: | COC(=O)C1=CSC=C1N.Cl |
InChI: | InChI=1S/C6H7NO2S.ClH/c1-9-6(8)4-2-10-3-5(4)7;/h2-3H,7H2,1H3;1H |
InChI Key: | JGIRDDQLZLXRKQ-UHFFFAOYSA-N |
Boiling Point: | 295.9 °C at 760 mmHg |
Appearance: | Solid |
MDL: | MFCD00068149 |
LogP: | 2.50010 |
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Related Functional Groups
Carbonyl Compounds
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
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