2-Chloro-1-{1-[(4-Methylphenyl)Sulfonyl]-1H-Pyrrol-3-Yl}Ethanone
[CAS# 124511-96-2]

Identification

• Name: 2-Chloro-1-{1-[(4-Methylphenyl)Sulfonyl]-1H-Pyrrol-3-Yl}Ethanone
• Synonyms: 2-chloranyl-1-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]ethanone; 2-chloro-1-[1-(4-methylphenyl)sulfonyl-3-pyrrolyl]ethanone; 3-(CHLOROACETYL)-1-TOSYLPYRROLE
• Molecular Formula: C₁₃H₁₂ClNO₃S
• Molecular Weight: 297.76
• CAS Registry Number: 124511-96-2
• SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)CCl
• InChI: 1S/C13H12ClNO3S/c1-10-2-4-12(5-3-10)19(17,18)15-7-6-11(9-15)13(16)8-14/h2-7,9H,8H2,1H3
• InChIKey: YOGUEUYPEHSNNN-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 478.8±55.0°C at 760 mmHg (Cal.)
• Flash point: 243.4±31.5°C (Cal.)
• Refractive index: 1.605 (Cal.)