Ethyl 2,2-dimethyl-3-(4-sulfanylphenyl)propanoate
[CAS# 869853-73-6]

Identification

• Name: Ethyl 2,2-dimethyl-3-(4-sulfanylphenyl)propanoate
• Synonyms: Ethyl 2,2-Dimethyl-3-(4-mercaptophenyl)propionate
• Molecular Formula: C₁₃H₁₈O₂S
• Molecular Weight: 238.35
• CAS Registry Number: 869853-73-6
• SMILES: O=C(OCC)C(Cc1ccc(S)cc1)(C)C
• InChI: 1S/C13H18O2S/c1-4-15-12(14)13(2,3)9-10-5-7-11(16)8-6-10/h5-8,16H,4,9H2,1-3H3
• InChIKey: GARCOZSVVMBQFJ-UHFFFAOYSA-N

Properties

• Density: 1.079g/cm³ (Cal.)
• Boiling point: 328.783°C at 760 mmHg (Cal.)
• Flash point: 202.052°C (Cal.)
• Refractive index: 1.536 (Cal.)