4-[(2R,3R)-2-(Hydroxymethyl)-7-[(E)-3-Hydroxyprop-1-Enyl]-2,3-Dihydro-1,4-Benzodioxin-3-Yl]Benzene-1,2-Diol
[CAS# 133838-65-0]

Identification

• Name: 4-[(2R,3R)-2-(Hydroxymethyl)-7-[(E)-3-Hydroxyprop-1-Enyl]-2,3-Dihydro-1,4-Benzodioxin-3-Yl]Benzene-1,2-Diol
• Synonyms: 4-[(2R,3R)-7-[(E)-3-Hydroxyprop-1-Enyl]-2-Methylol-2,3-Dihydro-1,4-Benzodioxin-3-Yl]Pyrocatechol; 1,2-Benzenediol, 4-((2R,3R)-2,3-Dihydro-3-(Hydroxymethyl)-6-((1E)-3-Hydroxy-1-Propenyl)-1,4-Benzodioxin-2-Yl)-, Rel-; 1,2-Benzenediol, 4-(2,3-Dihydro-3-(Hydroxymethyl)-6-(3-Hydroxy-1-Propenyl)-1,4-Benzodioxin-2-Yl)-, (2Alpha,3Beta,6(E))-
• Molecular Formula: C₁₈H₁₈O₆
• Molecular Weight: 330.34
• CAS Registry Number: 133838-65-0
• SMILES: [C@@H]2(OC1=CC=C(C=C1O[C@@H]2CO)\C=C\CO)C3=CC=C(O)C(=C3)O
• InChI: 1S/C18H18O6/c19-7-1-2-11-3-6-15-16(8-11)23-17(10-20)18(24-15)12-4-5-13(21)14(22)9-12/h1-6,8-9,17-22H,7,10H2/b2-1+/t17-,18-/m1/s1
• InChIKey: NKYXNCKZTCGVJJ-ZHEVZCJESA-N

Properties

• Density: 1.397g/cm³ (Cal.)
• Boiling point: 610.115°C at 760 mmHg (Cal.)
• Flash point: 322.786°C (Cal.)