4-Mercaptohydrocinnamic acid

• CAS: 63545-55-1
• Catalog Number: ACM63545551
• Category: Other Products
• Molecular Weight: 182.24
• Molecular Formula: C9H10O2S
• Synonyms: p-Mercaptohydrocinnamic acid
• IUPAC Name: 3-(4-Sulfanylphenyl)propanoic acid
• Canonical SMILES: C1=CC(=CC=C1CCC(=O)O)S
• InChI: InChI=1S/C9H10O2S/c10-9(11)6-3-7-1-4-8(12)5-2-7/h1-2,4-5,12H,3,6H2,(H,10,11)
• InChI Key: YQWPHBFLHAJVCG-UHFFFAOYSA-N
• Boiling Point: 345.1±17.0 °C
• Melting Point: 118 °C
• Density: 1.248±0.06 g/cm³
• Appearance: Yellow Powder
• Exact Mass: 182.04015073
• Monoisotopic Mass: 182.04015073
• Physical State: Powder
• Storage Conditions: -20 °C
• Topological Polar Surface Area: 38.3 Ų