2-[(Dichloroacetyl)Amino]-3-Hydroxy-3-[4-(Methylsulphonyl)Phenyl]Propyl Chloroacetate
[CAS# 84824-83-9]

Identification

• Name: 2-[(Dichloroacetyl)Amino]-3-Hydroxy-3-[4-(Methylsulphonyl)Phenyl]Propyl Chloroacetate
• Synonyms: 2-Chloroacetic Acid [2-[(2,2-Dichloro-1-Oxoethyl)Amino]-3-Hydroxy-3-(4-Methylsulfonylphenyl)Propyl] Ester; 2-Chloroacetic Acid [2-[(2,2-Dichloroacetyl)Amino]-3-Hydroxy-3-(4-Mesylphenyl)Propyl] Ester; [2-(2,2-Dichloroethanoylamino)-3-Hydroxy-3-(4-Methylsulfonylphenyl)Propyl] 2-Chloroethanoate
• Molecular Formula: C₁₄H₁₆Cl₃NO₆S
• Molecular Weight: 432.70
• CAS Registry Number: 84824-83-9
• EINECS: 284-235-6
• SMILES: C1=C(C(O)C(NC(=O)C(Cl)Cl)COC(=O)CCl)C=CC(=C1)[S](=O)(=O)C
• InChI: 1S/C14H16Cl3NO6S/c1-25(22,23)9-4-2-8(3-5-9)12(20)10(7-24-11(19)6-15)18-14(21)13(16)17/h2-5,10,12-13,20H,6-7H2,1H3,(H,18,21)
• InChIKey: ZSZQRRIQRPRATF-UHFFFAOYSA-N

Properties

• Density: 1.497g/cm³ (Cal.)
• Boiling point: 677.124°C at 760 mmHg (Cal.)
• Flash point: 363.311°C (Cal.)