3-Acetyl-5-(D-arabino-tetrahydrobutyl)-2-methylpyrrole
[CAS# 54351-43-8]

Identification

• Name: 3-Acetyl-5-(D-arabino-tetrahydrobutyl)-2-methylpyrrole
• Synonyms: 3-Acetyl-5-(D-Arabino-Tetrahydrobutyl)-2-Methylpyrrole; Ver I; Wer I
• Molecular Formula: C₁₁H₁₇NO₅
• Molecular Weight: 243.26
• CAS Registry Number: 54351-43-8
• SMILES: [C@@H](C1=CC(=C([NH]1)C)C(C)=O)([C@@H]([C@@H](CO)O)O)O
• InChI: 1S/C11H17NO5/c1-5-7(6(2)14)3-8(12-5)10(16)11(17)9(15)4-13/h3,9-13,15-17H,4H2,1-2H3/t9-,10-,11-/m1/s1
• InChIKey: OTGHXPARZDXDIM-GMTAPVOTSA-N

Properties

• Density: 1.407g/cm³ (Cal.)
• Boiling point: 575.221°C at 760 mmHg (Cal.)
• Flash point: 301.683°C (Cal.)