(1,1'-Biphenyl)-3-Yl-beta-D-Glucopyranosiduronic Acid
[CAS# 69618-85-5]

Identification

• Name: (1,1'-Biphenyl)-3-Yl-beta-D-Glucopyranosiduronic Acid
• Synonyms: (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(3-Phenylphenoxy)Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(3-Phenylphenoxy)-2-Tetrahydropyrancarboxylic Acid; Beta-D-Glucopyranosiduronic Acid, (1,1'-Biphenyl)-3-Yl
• Molecular Formula: C₁₈H₁₈O₇
• Molecular Weight: 346.34
• CAS Registry Number: 69618-85-5
• SMILES: [C@H]3(OC1=CC(=CC=C1)C2=CC=CC=C2)[C@H](O)[C@@H](O)[C@H](O)[C@H](O3)C(=O)O
• InChI: 1S/C18H18O7/c19-13-14(20)16(17(22)23)25-18(15(13)21)24-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9,13-16,18-21H,(H,22,23)/t13-,14-,15+,16-,18+/m0/s1
• InChIKey: QWAOLAZGPWUPMJ-RNGZQALNSA-N

Properties

• Density: 1.471g/cm³ (Cal.)
• Boiling point: 623.304°C at 760 mmHg (Cal.)
• Flash point: 229.248°C (Cal.)