(E)-4-(3,7-Dimethyl-2,6-Octadienyl)-1H-Pyrrole-2-Carboxylic Acid
[CAS# 144314-68-1]

Identification

• Name: (E)-4-(3,7-Dimethyl-2,6-Octadienyl)-1H-Pyrrole-2-Carboxylic Acid
• Synonyms: 4-(3,7-Dimethylocta-2,6-Dienyl)-1H-Pyrrole-2-Carboxylic Acid; 1H-Pyrrole-2-Carboxylic Acid, 4-(3,7-Dimethyl-2,6-Octadienyl)-, (E)-; 4-(3,7-Dimethyl-2,6-Octadienyl)-1H-Pyrrole-2-Carboxylic Acid (E)-
• Molecular Formula: C₁₅H₂₁NO₂
• Molecular Weight: 247.34
• CAS Registry Number: 144314-68-1
• SMILES: C1=C(C/C=C(/CCC=C(C)C)C)C=C([NH]1)C(O)=O
• InChI: 1S/C15H21NO2/c1-11(2)5-4-6-12(3)7-8-13-9-14(15(17)18)16-10-13/h5,7,9-10,16H,4,6,8H2,1-3H3,(H,17,18)/b12-7+
• InChIKey: UEQIBCOZMSTCSW-KPKJPENVSA-N

Properties

• Density: 1.066g/cm³ (Cal.)
• Boiling point: 440.825°C at 760 mmHg (Cal.)
• Flash point: 220.404°C (Cal.)