Ethyl 3-[4-(chlorosulfonyl)phenyl]-2,2-dimethylpropanoate
[CAS# 887355-04-6]

Identification

• Name: Ethyl 3-[4-(chlorosulfonyl)phenyl]-2,2-dimethylpropanoate
• Synonyms: Ethyl 2,2-Dimethyl-3-(4-chlorosulfonylphenyl)propionate
• Molecular Formula: C₁₃H₁₇ClO₄S
• Molecular Weight: 304.79
• CAS Registry Number: 887355-04-6
• SMILES: ClS(=O)(=O)c1ccc(cc1)CC(C(=O)OCC)(C)C
• InChI: 1S/C13H17ClO4S/c1-4-18-12(15)13(2,3)9-10-5-7-11(8-6-10)19(14,16)17/h5-8H,4,9H2,1-3H3
• InChIKey: JELQKGCZSKGTBM-UHFFFAOYSA-N

Properties

• Density: 1.244g/cm³ (Cal.)
• Boiling point: 381.553°C at 760 mmHg (Cal.)
• Flash point: 184.557°C (Cal.)
• Refractive index: 1.522 (Cal.)