[R-(R*,R*)]-Hexadecanoic Acid 2-[(Dichloroacetyl)Amino]-3-Hydroxy-3-[4-(Methylsulfonyl)Phenyl]Propyl Ester
[CAS# 21478-01-3]

Identification

• Name: [R-(R*,R*)]-Hexadecanoic Acid 2-[(Dichloroacetyl)Amino]-3-Hydroxy-3-[4-(Methylsulfonyl)Phenyl]Propyl Ester
• Synonyms: Hexadecanoic Acid [2-[(2,2-Dichloro-1-Oxoethyl)Amino]-3-Hydroxy-3-(4-Methylsulfonylphenyl)Propyl] Ester; Palmitic Acid [2-[(2,2-Dichloroacetyl)Amino]-3-Hydroxy-3-(4-Mesylphenyl)Propyl] Ester; [2-(2,2-Dichloroethanoylamino)-3-Hydroxy-3-(4-Methylsulfonylphenyl)Propyl] Hexadecanoate
• Molecular Formula: C₂₈H₄₅Cl₂NO₆S
• Molecular Weight: 594.63
• CAS Registry Number: 21478-01-3
• EINECS: 244-404-7
• SMILES: C1=CC(=CC=C1[S](=O)(=O)C)C(O)C(NC(=O)C(Cl)Cl)COC(=O)CCCCCCCCCCCCCCC
• InChI: 1S/C28H45Cl2NO6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25(32)37-21-24(31-28(34)27(29)30)26(33)22-17-19-23(20-18-22)38(2,35)36/h17-20,24,26-27,33H,3-16,21H2,1-2H3,(H,31,34)
• InChIKey: MYPUUWZQHGIRSY-UHFFFAOYSA-N

Properties

• Density: 1.169g/cm³ (Cal.)
• Boiling point: 733.415°C at 760 mmHg (Cal.)
• Flash point: 397.355°C (Cal.)