3-Thiophenemalonic Acid

• CAS: 21080-92-2
• Catalog Number: ACM-MO-21080922
• Category: Polymer/Macromolecule; Carboxylic Acid Monomers
• Molecular Weight: 186.19 g/mol
• Molecular Formula: C7H6O4S
• Synonyms: 2-(3-thiophenyl)propanedioic acid; 2-thiophen-3-ylpropanedioic acid
• IUPAC Name: 2-thiophen-3-ylpropanedioic acid
• Canonical SMILES: OC(=O)C(C(O)=O)c1ccsc1
• InChI: 1S/C7H6O4S/c8-6(9)5(7(10)11)4-1-2-12-3-4/h1-3,5H,(H,8,9)(H,10,11)
• InChI Key: GCOOGCQWQFRJEK-UHFFFAOYSA-N
• Melting Point: 139 °C (dec.) (lit.)
• Appearance: Off-White to Beige Powder or Chunks
• Application: This product is suitable for scientific research.
• Assay: 97%
• Complexity: 190
• Covalently-Bonded Unit Count: 1
• EC Number: 244-198-9
• Exact Mass: 185.99868g/mol
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• Formal Charge: 0
• H-Bond Acceptor: 5
• H-Bond Donor: 2
• Heavy Atom Count: 12
• MDL Number: MFCD00005469
• Monoisotopic Mass: 185.99868g/mol
• NACRES: NA.23
• Physical State: Solid
• PubChem ID: 24852885
• Quality Level: 100
• Rotatable Bond Count: 3
• XLogP3: 0.9