4-(4,4-Dimethyl-3-hydroxy-1-pentenyl)pyrocatechol
[CAS# 66596-49-4]

Identification

• Name: 4-(4,4-Dimethyl-3-hydroxy-1-pentenyl)pyrocatechol
• Synonyms: 4-[(E)-3-Hydroxy-4,4-Dimethyl-Pent-1-Enyl]Benzene-1,2-Diol; 4-[(E)-3-Hydroxy-4,4-Dimethyl-Pent-1-Enyl]Pyrocatechol; 4-(4,4-Dimethyl-3-Hydroxy-1-Pentenyl)Pyrocatechol
• Molecular Formula: C₁₃H₁₈O₃
• Molecular Weight: 222.28
• CAS Registry Number: 66596-49-4
• SMILES: C1=C(O)C(=CC=C1\C=C\C(O)C(C)(C)C)O
• InChI: 1S/C13H18O3/c1-13(2,3)12(16)7-5-9-4-6-10(14)11(15)8-9/h4-8,12,14-16H,1-3H3/b7-5+
• InChIKey: BUCYIZKIFHMFOW-FNORWQNLSA-N

Properties

• Density: 1.162g/cm³ (Cal.)
• Boiling point: 400.139°C at 760 mmHg (Cal.)
• Flash point: 192.704°C (Cal.)