Ethyl 3-(Methylsulfanyl)-5-Oxo-2,5-Dihydro-1,2,4-Triazine-6-Carboxylate
[CAS# 31339-07-8]

Identification

• Name: Ethyl 3-(Methylsulfanyl)-5-Oxo-2,5-Dihydro-1,2,4-Triazine-6-Carboxylate
• Synonyms: 1,2,4-Triazine-6-carboxylic acid, 4,5-dihydro-3-methylthio-5-oxo-, ethyl ester; Ethyl 3-(methylsulfanyl)-5-oxo-2,5-dihydro-1,2,4-triazine-6-carboxylate; Ethyl 3-(methylsulfanyl)-5-oxo-4,5-dihydro-1,2,4-triazine-6-carboxylate
• Molecular Formula: C₇H₉N₃O₃S
• Molecular Weight: 215.23
• CAS Registry Number: 31339-07-8
• SMILES: O=C\1\N=C(\SC)N/N=C/1C(=O)OCC
• InChI: 1S/C7H9N3O3S/c1-3-13-6(12)4-5(11)8-7(14-2)10-9-4/h3H2,1-2H3,(H,8,10,11)
• InChIKey: LVODHNQSZJASHM-UHFFFAOYSA-N

Properties

• Density: 1.487g/cm³ (Cal.)
• Boiling point: 306.875°C at 760 mmHg (Cal.)
• Flash point: 139.393°C (Cal.)