2-Hydroxy-3-(4-Methoxyphenyl)-3-[(2-Nitrophenyl)Sulfanyl]Propanoic Acid
[CAS# 30067-06-2]

Identification

• Name: 2-Hydroxy-3-(4-Methoxyphenyl)-3-[(2-Nitrophenyl)Sulfanyl]Propanoic Acid
• Synonyms: 2-HYDROXY-3-(4-METHOXY-PHENYL)-3-(2-NITRO-PHENYLSULFANYL)-PROPIONICACID
• Molecular Formula: C₁₆H₁₅NO₆S
• Molecular Weight: 349.36
• CAS Registry Number: 30067-06-2
• SMILES: [O-][N+](=O)c2ccccc2SC(c1ccc(OC)cc1)C(O)C(=O)O
• InChI: 1S/C16H15NO6S/c1-23-11-8-6-10(7-9-11)15(14(18)16(19)20)24-13-5-3-2-4-12(13)17(21)22/h2-9,14-15,18H,1H3,(H,19,20)
• InChIKey: MAZQSTHKJABVOC-UHFFFAOYSA-N

Properties

• Density: 1.455g/cm³ (Cal.)
• Boiling point: 549.835°C at 760 mmHg (Cal.)
• Flash point: 286.33°C (Cal.)
• Refractive index: 1.663 (Cal.)