(E)-3-(4-Ethoxycarbonyl-2,5-Dimethyl-1H-Pyrrol-3-Yl)Prop-2-Enoic Acid
[CAS# 5443-41-4]

Identification

• Name: (E)-3-(4-Ethoxycarbonyl-2,5-Dimethyl-1H-Pyrrol-3-Yl)Prop-2-Enoic Acid
• Synonyms: 3-(4-Ethoxycarbonyl-2,5-Dimethyl-1H-Pyrrol-3-Yl)Prop-2-Enoic Acid; (E)-3-(4-Carbethoxy-2,5-Dimethyl-1H-Pyrrol-3-Yl)Acrylic Acid; 3-(4-Carbethoxy-2,5-Dimethyl-1H-Pyrrol-3-Yl)Acrylic Acid
• Molecular Formula: C₁₂H₁₅NO₄
• Molecular Weight: 237.25
• CAS Registry Number: 5443-41-4
• SMILES: C(C)OC(=O)C1=C([NH]C(=C1\C=C\C(=O)O)C)C
• InChI: 1S/C12H15NO4/c1-4-17-12(16)11-8(3)13-7(2)9(11)5-6-10(14)15/h5-6,13H,4H2,1-3H3,(H,14,15)/b6-5+
• InChIKey: WCLGMNCYFCZZDZ-AATRIKPKSA-N

Properties

• Density: 1.247g/cm³ (Cal.)
• Boiling point: 467.126°C at 760 mmHg (Cal.)
• Flash point: 236.31°C (Cal.)