(2R,3R)-2,3-Dihydroxysuccinic acid - 1-(3-{[5-(4-chlorophenyl)-4-methyl-1H-pyrazol-3-yl]oxy}propyl)piperidine (1:1)
[CAS# 86871-79-6]

Identification

• Name: (2R,3R)-2,3-Dihydroxysuccinic acid - 1-(3-{[5-(4-chlorophenyl)-4-methyl-1H-pyrazol-3-yl]oxy}propyl)piperidine (1:1)
• Synonyms: Piperidine, 1-(3-((5-(4-chlorophenyl)-4-methyl-1H-pyrazol-3-yl)oxy)propyl)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (1:1)
• Molecular Formula: C₂₂H₃₀ClN₃O₇
• Molecular Weight: 483.94
• CAS Registry Number: 86871-79-6
• SMILES: O=C(O)[C@H](O)[C@@H](O)C(=O)O.Clc1ccc(cc1)c2c(c(nn2)OCCCN3CCCCC3)C
• InChI: 1S/C18H24ClN3O.C4H6O6/c1-14-17(15-6-8-16(19)9-7-15)20-21-18(14)23-13-5-12-22-10-3-2-4-11-22;5-1(3(7)8)2(6)4(9)10/h6-9H,2-5,10-13H2,1H3,(H,20,21);1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.1/s1
• InChIKey: DEZRLIVCOXPLBI-LREBCSMRSA-N

Properties

• Boiling point: 506°C at 760 mmHg (Cal.)
• Flash point: 259.8°C (Cal.)