5-Iodo-1-Benzothiophene-2-Carboxylic Acid
[CAS# 195607-61-5]

Identification

• Name: 5-Iodo-1-Benzothiophene-2-Carboxylic Acid
• Synonyms: 2-Carboxy-5-iodobenzo[b]thiophene
• Molecular Formula: C₉H₅IO₂S
• Molecular Weight: 304.10
• CAS Registry Number: 195607-61-5
• SMILES: OC(=O)c1cc2cc(I)ccc2s1
• InChI: 1S/C9H5IO2S/c10-6-1-2-7-5(3-6)4-8(13-7)9(11)12/h1-4H,(H,11,12)
• InChIKey: QZPAVQCVSMWWSC-UHFFFAOYSA-N

Properties

• Density: 2.06g/cm³ (Cal.)
• Boiling point: 450.643°C at 760 mmHg (Cal.)
• Flash point: 226.341°C (Cal.)
• Refractive index: 1.786 (Cal.)

Safety Data

• Safety Description: Harmful/Irritant/Light Sensitive/Keep Cold