N-[2-(4-Chlorophenyl)Sulfanylethyl]-2,4-Dihydroxy-3,3-Dimethylpentanamide
[CAS# 33406-95-0]

Identification

• Name: N-[2-(4-Chlorophenyl)Sulfanylethyl]-2,4-Dihydroxy-3,3-Dimethylpentanamide
• Synonyms: N-[2-(4-Chlorophenyl)Sulfanylethyl]-2,4-Dihydroxy-3,3-Dimethyl-Pentanamide; N-[2-[(4-Chlorophenyl)Thio]Ethyl]-2,4-Dihydroxy-3,3-Dimethylpentanamide; N-[2-[(4-Chlorophenyl)Thio]Ethyl]-2,4-Dihydroxy-3,3-Dimethyl-Valeramide
• Molecular Formula: C₁₅H₂₂ClNO₃S
• Molecular Weight: 331.86
• CAS Registry Number: 33406-95-0
• SMILES: C1=CC(=CC=C1SCCNC(=O)C(C(C)(C(C)O)C)O)Cl
• InChI: 1S/C15H22ClNO3S/c1-10(18)15(2,3)13(19)14(20)17-8-9-21-12-6-4-11(16)5-7-12/h4-7,10,13,18-19H,8-9H2,1-3H3,(H,17,20)
• InChIKey: HWNSYNIAIVZAGB-UHFFFAOYSA-N

Properties

• Density: 1.257g/cm³ (Cal.)
• Boiling point: 570.124°C at 760 mmHg (Cal.)
• Flash point: 298.601°C (Cal.)