3-Methoxy-5-Nitro-2,3-Dihydro-1-Benzothiophene-3-Carboxylic Acid
[CAS# 26759-54-6]

Identification

• Name: 3-Methoxy-5-Nitro-2,3-Dihydro-1-Benzothiophene-3-Carboxylic Acid
• Synonyms: 3-methoxy-5-nitrobenzo[b]thiophene-3-carboxylic acid
• Molecular Formula: C₁₀H₉NO₅S
• Molecular Weight: 255.25
• CAS Registry Number: 26759-54-6
• EINECS: 247-974-5
• SMILES: [O-][N+](=O)c1cc2c(cc1)SCC2(OC)C(O)=O
• InChI: 1S/C10H9NO5S/c1-16-10(9(12)13)5-17-8-3-2-6(11(14)15)4-7(8)10/h2-4H,5H2,1H3,(H,12,13)
• InChIKey: NFMXSYDULAKEKH-UHFFFAOYSA-N

Properties

• Density: 1.559g/cm³ (Cal.)
• Boiling point: 461.991°C at 760 mmHg (Cal.)
• Flash point: 233.204°C (Cal.)
• Refractive index: 1.663 (Cal.)