Ethyl 4-Hydroxy-5-Oxo-1-(2-Thienylmethyl)-2,5-Dihydro-1H-Pyrrole-3-Carboxylate
[CAS# 131436-78-7]

Identification

• Name: Ethyl 4-Hydroxy-5-Oxo-1-(2-Thienylmethyl)-2,5-Dihydro-1H-Pyrrole-3-Carboxylate
• Synonyms: 1H-pyrrole-3-carboxylic acid, 2,5-dihydro-4-hydroxy-5-oxo-1-(2-thienylmethyl)-, ethyl ester; 4-Hydroxy-5-oxo-1-thiophen-2-ylmethyl-2,5-dihydro-1H-pyrrole-3-carboxylic acid ethyl ester; Ethyl 4-hydroxy-5-oxo-1-(2-thienylmethyl)-2,5-dihydro-1H-pyrrole-3-carboxylate
• Molecular Formula: C₁₂H₁₃NO₄S
• Molecular Weight: 267.30
• CAS Registry Number: 131436-78-7
• SMILES: CCOC(=O)C1=C(C(=O)N(C1)CC2=CC=CS2)O
• InChI: 1S/C12H13NO4S/c1-2-17-12(16)9-7-13(11(15)10(9)14)6-8-4-3-5-18-8/h3-5,14H,2,6-7H2,1H3
• InChIKey: LCDLJTYTVMVKMU-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Melting point: 98-100°C (Expl.)
• Boiling point: 489.5±45.0°C at 760 mmHg (Cal.)
• Flash point: 249.8±28.7°C (Cal.)
• Refractive index: 1.64 (Cal.)

Safety Data

• Safety Description: IRRITANT