2-(Acetylamino)-3-phenyl-2-propenoic acid

• Catalog Number: ACM5469454
• Product Name: 2-(Acetylamino)-3-phenyl-2-propenoic acid
• CAS: 5469-45-4
• Category: Heterocyclic Organic Compound
• Synonyms: (E)-2-Acetamido-3-phenylprop-2-enoic acid
• Molecular Weight: 205.21
• Molecular Formula: C₁₁H₁₁NO₃
• InChI: InChI=1S/C11H11NO3/c1-8(13)12-10(11(14)15)7-9-5-3-2-4-6-9/h2-7H,1H3,(H,12,13)(H,14,15)/b10-7-
• InChI Key: XODAOBAZOQSFDS-YFHOEESVSA-N
• Melting Point: 188-190 °C
• Complexity: 278
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Exact Mass: 205.07389321
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 2
• Isomeric SMILES: CC(=O)N/C(=C\C1=CC=CC=C1)/C(=O)O
• Monoisotopic Mass: 205.07389321
• Physical State: Powder
• Rotatable Bond Count: 3
• Topological Polar Surface Area: 66.4 Ų