(2E)-2-Cyano-3-(1-cyclopropyl-2,5-dimethyl-1H-pyrrol-3-yl)acrylic acid
[CAS# 790270-77-8]

Identification

• Name: (2E)-2-Cyano-3-(1-cyclopropyl-2,5-dimethyl-1H-pyrrol-3-yl)acrylic acid
• Synonyms: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-1H-pyrrol-3-yl)acrylic acid; MFCD06357825
• Molecular Formula: C₁₃H₁₄N₂O₂
• Molecular Weight: 230.26
• CAS Registry Number: 790270-77-8
• SMILES: CC1=CC(=C(N1C2CC2)C)/C=C(\C#N)/C(=O)O
• InChI: 1S/C13H14N2O2/c1-8-5-10(6-11(7-14)13(16)17)9(2)15(8)12-3-4-12/h5-6,12H,3-4H2,1-2H3,(H,16,17)/b11-6+
• InChIKey: MTDDKQZLYRCIHS-IZZDOVSWSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 425.4±45.0°C at 760 mmHg (Cal.)
• Flash point: 211.1±28.7°C (Cal.)
• Refractive index: 1.614 (Cal.)