(R*,R*)-4-[Isopropylthio]-alpha-[1-(Octylamino)Ethyl]Benzyl Alcohol
[CAS# 54767-44-1]

Identification

• Name: (R*,R*)-4-[Isopropylthio]-alpha-[1-(Octylamino)Ethyl]Benzyl Alcohol
• Synonyms: 1-(4-Isopropylsulfanylphenyl)-2-(Octylamino)Propan-1-Ol; 1-[4-(Isopropylthio)Phenyl]-2-(Octylamino)Propan-1-Ol; Kbio2_004193
• Molecular Formula: C₂₀H₃₅NOS
• Molecular Weight: 337.56
• CAS Registry Number: 54767-44-1
• EINECS: 259-329-5
• SMILES: C1=C(C=CC(=C1)SC(C)C)C(C(NCCCCCCCC)C)O
• InChI: 1S/C20H35NOS/c1-5-6-7-8-9-10-15-21-17(4)20(22)18-11-13-19(14-12-18)23-16(2)3/h11-14,16-17,20-22H,5-10,15H2,1-4H3
• InChIKey: BFCDFTHTSVTWOG-UHFFFAOYSA-N

Properties

• Density: 0.994g/cm³ (Cal.)
• Boiling point: 467.299°C at 760 mmHg (Cal.)
• Flash point: 236.414°C (Cal.)