(2S,3R,5E)-5-Ethylidene-2-(Hydroxymethyl)-3-Methyl-6-Oxooxane-2-Carboxylic Acid
[CAS# 34081-95-3]

Identification

• Name: (2S,3R,5E)-5-Ethylidene-2-(Hydroxymethyl)-3-Methyl-6-Oxooxane-2-Carboxylic Acid
• Synonyms: (2S,3R,5E)-5-Ethylidene-2-(Hydroxymethyl)-3-Methyl-6-Oxo-Tetrahydropyran-2-Carboxylic Acid; (2S,3R,5E)-5-Ethylidene-2-(Hydroxymethyl)-3-Methyl-6-Oxo-2-Tetrahydropyrancarboxylic Acid; (2S,3R,5E)-5-Ethylidene-6-Keto-3-Methyl-2-Methylol-Tetrahydropyran-2-Carboxylic Acid
• Molecular Formula: C₁₀H₁₄O₅
• Molecular Weight: 214.22
• CAS Registry Number: 34081-95-3
• SMILES: [C@]1([C@@H](C\C(C(O1)=O)=C/C)C)(C(=O)O)CO
• InChI: 1S/C10H14O5/c1-3-7-4-6(2)10(5-11,9(13)14)15-8(7)12/h3,6,11H,4-5H2,1-2H3,(H,13,14)/b7-3+/t6-,10-/m1/s1
• InChIKey: JZDOPVJGRYDTPH-YDPIVCLTSA-N

Properties

• Density: 1.335g/cm³ (Cal.)
• Boiling point: 455.207°C at 760 mmHg (Cal.)
• Flash point: 182.919°C (Cal.)