2,4-Dihydroxy-3,3-Dimethyl-N-(2-Phenylsulfanylethyl)Butanamide
[CAS# 6641-86-7]

Identification

• Name: 2,4-Dihydroxy-3,3-Dimethyl-N-(2-Phenylsulfanylethyl)Butanamide
• Synonyms: 2,4-Dihydroxy-3,3-Dimethyl-N-[2-(Phenylthio)Ethyl]Butanamide; 2,4-Dihydroxy-3,3-Dimethyl-N-[2-(Phenylthio)Ethyl]Butyramide; Nsc15987
• Molecular Formula: C₁₄H₂₁NO₃S
• Molecular Weight: 283.38
• CAS Registry Number: 6641-86-7
• SMILES: C1=C(SCCNC(C(C(CO)(C)C)O)=O)C=CC=C1
• InChI: 1S/C14H21NO3S/c1-14(2,10-16)12(17)13(18)15-8-9-19-11-6-4-3-5-7-11/h3-7,12,16-17H,8-10H2,1-2H3,(H,15,18)
• InChIKey: PVVYCHZEUSXOKM-UHFFFAOYSA-N

Properties

• Density: 1.2g/cm³ (Cal.)
• Boiling point: 546.665°C at 760 mmHg (Cal.)
• Flash point: 284.413°C (Cal.)