(2R)-2-Acetamido-3-(4-Bromo-2,5-Dihydroxyphenyl)Sulfanylpropanoic Acid
[CAS# 126216-13-5]

Identification

• Name: (2R)-2-Acetamido-3-(4-Bromo-2,5-Dihydroxyphenyl)Sulfanylpropanoic Acid
• Synonyms: (2R)-2-Acetamido-3-(4-Bromo-2,5-Dihydroxy-Phenyl)Sulfanyl-Propanoic Acid; (2R)-2-Acetamido-3-[(4-Bromo-2,5-Dihydroxyphenyl)Thio]Propanoic Acid; (2R)-2-Acetamido-3-[(4-Bromo-2,5-Dihydroxy-Phenyl)Thio]Propionic Acid
• Molecular Formula: C₁₁H₁₂BrNO₅S
• Molecular Weight: 350.18
• CAS Registry Number: 126216-13-5
• SMILES: [C@H](NC(=O)C)(CSC1=CC(=C(Br)C=C1O)O)C(=O)O
• InChI: 1S/C11H12BrNO5S/c1-5(14)13-7(11(17)18)4-19-10-3-8(15)6(12)2-9(10)16/h2-3,7,15-16H,4H2,1H3,(H,13,14)(H,17,18)/t7-/m0/s1
• InChIKey: BAWSSZXNXYCICI-ZETCQYMHSA-N

Properties

• Density: 1.812g/cm³ (Cal.)
• Boiling point: 591.365°C at 760 mmHg (Cal.)
• Flash point: 311.447°C (Cal.)