(1S,3R,4S,4aS,7aS)-1,4-Dihydroxy-3-(Hydroxymethyl)-7-Methyl-3,4,4A,7A-Tetrahydrocyclopenta[c]Pyran-5(1H)-One
[CAS# 251914-61-1]

Identification

• Name: (1S,3R,4S,4aS,7aS)-1,4-Dihydroxy-3-(Hydroxymethyl)-7-Methyl-3,4,4A,7A-Tetrahydrocyclopenta[c]Pyran-5(1H)-One
• Synonyms: (1S,3R,4S,4aS,7aS)-1,4-dihydroxy-3-(hydroxymethyl)-7-methyl-1,4,4a,7a-tetrahydrocyclopenta[c]pyran-5(3H)-one
• Molecular Formula: C₁₀H₁₄O₅
• Molecular Weight: 214.22
• CAS Registry Number: 251914-61-1
• SMILES: O=C1\C=C(/[C@@H]2[C@H]1[C@H](O)[C@H](O[C@@H]2O)CO)C
• InChI: 1S/C10H14O5/c1-4-2-5(12)8-7(4)10(14)15-6(3-11)9(8)13/h2,6-11,13-14H,3H2,1H3/t6-,7-,8+,9-,10+/m1/s1
• InChIKey: VKXMPKPEYJXFJT-SPFKKGSWSA-N

Properties

• Density: 1.409g/cm³ (Cal.)
• Boiling point: 480.462°C at 760 mmHg (Cal.)
• Flash point: 195.631°C (Cal.)
• Refractive index: 1.577 (Cal.)