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4-Carboxycinnamic acid
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4-Carboxycinnamic acid

CAS 19675-63-9
Structure
Synonyms 3-(4-Carboxyphenyl)acrylic acid
IUPAC Name 4-[(E)-2-Carboxyethenyl]benzoic acid
Molecular Weight 192.17
Canonical SMILES C1=CC(=CC=C1C=CC(=O)O)C(=O)O
InChI InChI=1S/C10H8O4/c11-9(12)6-3-7-1-4-8(5-2-7)10(13)14/h1-6H,(H,11,12)(H,13,14)/b6-3+
InChI Key HAEJSGLKJYIYTB-ZZXKWVIFSA-N
Boiling Point 248.14 °C
Melting Point >300 °C
Purity 95%+
Density 1.0825 g/cm³ at 25 °C(lit.)
Exact Mass 192.04225873
Isomeric SMILES C1=CC(=CC=C1/C=C/C(=O)O)C(=O)O
Monoisotopic Mass 192.04225873
Refractive Index n20/D 1.4440(lit.)
Storage Conditions Dry place,Room Temperature
Topological Polar Surface Area 74.6 Ų

For Research Use Only. Not for use in diagnostic or therapeutic procedures.