2,5-Dimethylcinnamic acid

• CAS: 95883-10-6
• Catalog Number: ACM95883106
• Category: Other Products
• Molecular Weight: 176.21
• Molecular Formula: C₁₁H₁₂O₂
• Synonyms: 3-(2,5-Dimethylphenyl)acrylic acid
• IUPAC Name: (E)-3-(2,5-Dimethylphenyl)prop-2-enoic acid
• Canonical SMILES: CC1=CC(=C(C=C1)C)C=CC(=O)O
• InChI: InChI=1S/C11H12O2/c1-8-3-4-9(2)10(7-8)5-6-11(12)13/h3-7H,1-2H3,(H,12,13)/b6-5+
• InChI Key: FAIBVLSPNAHVSQ-AATRIKPKSA-N
• Melting Point: 129-131 °C
• Solubility: Insoluble in water
• Exact Mass: 176.083729621
• Isomeric SMILES: CC1=CC(=C(C=C1)C)/C=C/C(=O)O
• Monoisotopic Mass: 176.083729621
• Storage Conditions: 2-8 °C
• Topological Polar Surface Area: 37.3 Ų