5-(Hydroxymethyl)-1-(3-Methylbutyl)Pyrrole-2-Carbaldehyde
[CAS# 133086-80-3]

Identification

• Name: 5-(Hydroxymethyl)-1-(3-Methylbutyl)Pyrrole-2-Carbaldehyde
• Synonyms: 5-(Hydroxymethyl)-1-Isopentyl-Pyrrole-2-Carbaldehyde; 5-(Hydroxymethyl)-1-Isopentyl-2-Pyrrolecarboxaldehyde; 1-Isoamyl-5-Methylol-Pyrrole-2-Carbaldehyde
• Molecular Formula: C₁₁H₁₇NO₂
• Molecular Weight: 195.26
• CAS Registry Number: 133086-80-3
• SMILES: C1=C([N](C(=C1)CO)CCC(C)C)C=O
• InChI: 1S/C11H17NO2/c1-9(2)5-6-12-10(7-13)3-4-11(12)8-14/h3-4,7,9,14H,5-6,8H2,1-2H3
• InChIKey: QFUKUPZJJSMEGE-UHFFFAOYSA-N

Properties

• Density: 1.057g/cm³ (Cal.)
• Boiling point: 341.396°C at 760 mmHg (Cal.)
• Flash point: 160.271°C (Cal.)