5-S-Cysteinyldopamine
[CAS# 99558-89-1]

Identification

• Name: 5-S-Cysteinyldopamine
• Synonyms: (2R)-2-Amino-3-[5-(2-Aminoethyl)-2,3-Dihydroxy-Phenyl]Sulfanyl-Propanoic Acid; (2R)-2-Amino-3-[[5-(2-Aminoethyl)-2,3-Dihydroxyphenyl]Thio]Propanoic Acid; (2R)-2-Amino-3-[[5-(2-Aminoethyl)-2,3-Dihydroxy-Phenyl]Thio]Propionic Acid
• Molecular Formula: C₁₁H₁₆N₂O₄S
• Molecular Weight: 272.32
• CAS Registry Number: 99558-89-1
• SMILES: [C@@H](C(=O)O)(CSC1=C(C(=CC(=C1)CCN)O)O)N
• InChI: 1S/C11H16N2O4S/c12-2-1-6-3-8(14)10(15)9(4-6)18-5-7(13)11(16)17/h3-4,7,14-15H,1-2,5,12-13H2,(H,16,17)/t7-/m0/s1
• InChIKey: BZYHBWCVRKSWDB-ZETCQYMHSA-N

Properties

• Density: 1.491g/cm³ (Cal.)
• Boiling point: 512.468°C at 760 mmHg (Cal.)
• Flash point: 263.731°C (Cal.)