4-[(6-Deoxy-alpha-L-Mannopyranosyl)Amino]-Benzoic Acid Sodium Salt
[CAS# 72880-48-9]

Identification

• Name: 4-[(6-Deoxy-alpha-L-Mannopyranosyl)Amino]-Benzoic Acid Sodium Salt
• Synonyms: Sodium 4-[[(2S,3S,4S,5S,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Amino]Benzoate; Sodium 4-[[(2S,3S,4S,5S,6S)-3,4,5-Trihydroxy-6-Methyl-2-Tetrahydropyranyl]Amino]Benzoate; Sodium 4-[[(2S,3S,4S,5S,6S)-3,4,5-Trihydroxy-6-Methyl-Oxan-2-Yl]Amino]Benzoate
• Molecular Formula: C₁₃H₁₆NNaO₆
• Molecular Weight: 305.26
• CAS Registry Number: 72880-48-9
• SMILES: [C@@H]1(O[C@H]([C@@H](O)[C@H](O)[C@@H]1O)C)NC2=CC=C(C=C2)C([O-])=O.[Na+]
• InChI: 1S/C13H17NO6.Na/c1-6-9(15)10(16)11(17)12(20-6)14-8-4-2-7(3-5-8)13(18)19;/h2-6,9-12,14-17H,1H3,(H,18,19);/q;+1/p-1/t6-,9+,10-,11-,12-;/m0./s1
• InChIKey: AWBWOLJSUHOYLE-OOZXIQEGSA-M

Properties

• Boiling point: 558.9°C at 760 mmHg (Cal.)
• Flash point: 291.8°C (Cal.)