Ethyl beta-D-Glucopyranosiduronic Acid
[CAS# 17685-04-0]

Identification

• Classification: Analytical chemistry >> Standard >> Standard material
• Name: Ethyl beta-D-Glucopyranosiduronic Acid
• Synonyms: (2S,3S,4S,5R)-6-Ethoxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R)-6-Ethoxy-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4S,5R)-6-Ethoxy-3,4,5-Trihydroxy-Oxane-2-Carboxylic Acid
• Molecular Formula: C₈H₁₄O₇
• Molecular Weight: 222.19
• CAS Registry Number: 17685-04-0
• SMILES: [C@@H]1(C(OCC)O[C@@H]([C@H]([C@@H]1O)O)C(=O)O)O
• InChI: 1S/C8H14O7/c1-2-14-8-5(11)3(9)4(10)6(15-8)7(12)13/h3-6,8-11H,2H2,1H3,(H,12,13)/t3-,4-,5+,6-,8?/m0/s1
• InChIKey: IWJBVMJWSPZNJH-XWBUKDKVSA-N

Properties

• Density: 1.528g/cm³ (Cal.)
• Boiling point: 460.042°C at 760 mmHg (Cal.)
• Flash point: 187.314°C (Cal.)