2,3-Dichlorocinnamic acid

• Catalog Number: ACM20595442
• Product Name: 2,3-Dichlorocinnamic acid
• CAS: 20595-44-2
• Category: Heterocyclic Organic Compound
• Synonyms: (E)-3-(2,3-Dichlorophenyl)-2-propenoic acid
• IUPAC Name: (E)-3-(2,3-Dichlorophenyl)prop-2-enoic acid
• Molecular Weight: 217.05
• Molecular Formula: C9H6Cl2O2
• Canonical SMILES: C1=CC(=C(C(=C1)Cl)Cl)C=CC(=O)O
• InChI: InChI=1S/C9H6Cl2O2/c10-7-3-1-2-6(9(7)11)4-5-8(12)13/h1-5H,(H,12,13)/b5-4+
• InChI Key: RCEWIEGWGDHVNK-SNAWJCMRSA-N
• Boiling Point: 363.0±32.0 °C
• Melting Point: 229-234 °C
• Density: 1.457 g/mL at 25 °C(lit.)
• Exact Mass: 215.9744848
• Isomeric SMILES: C1=CC(=C(C(=C1)Cl)Cl)/C=C/C(=O)O
• Monoisotopic Mass: 215.9744848
• Storage Conditions: 2-8 °C
• Topological Polar Surface Area: 37.3 Ų