4-Nitrothiophene-2-carboxylic acid

• CAS: 13138-70-0
• Catalog Number: ACM13138700
• Category: Other Products
• Molecular Weight: 173.15
• Molecular Formula: C5H3NO4S
• Synonyms: 2-Thiophenecarboxylic acid, 4-nitro-
• IUPAC Name: 4-nitrothiophene-2-carboxylic acid
• Canonical SMILES: C1=C(SC=C1[N+](=O)[O-])C(=O)O
• InChI: InChI=1S/C5H3NO4S/c7-5(8)4-1-3(2-11-4)6(9)10/h1-2H,(H,7,8)
• InChI Key: SZHKHACZQDMGGI-UHFFFAOYSA-N
• Boiling Point: 383.3ºC at 760mmHg
• Flash Point: 185.6ºC
• Density: 1.676g/cm³
• Exact Mass: 172.97800
• H-Bond Acceptor: 4
• H-Bond Donor: 1