Thiofentanil Oxalate
[CAS# 73005-06-8]

Identification

• Name: Thiofentanil Oxalate
• Synonyms: Methyl 4-(Phenyl-Propanoyl-Amino)-1-[2-(2-Thienyl)Ethyl]Piperidine-4-Carboxylate; Oxalic Acid; Oxalic Acid; 4-(1-Oxopropyl-Phenylamino)-1-[2-(2-Thienyl)Ethyl]-4-Piperidinecarboxylic Acid Methyl Ester; Oxalic Acid; 4-(Phenyl-Propionyl-Amino)-1-[2-(2-Thienyl)Ethyl]Isonipecotic Acid Methyl Ester
• Molecular Formula: C₂₄H₃₀N₂O₇S
• Molecular Weight: 490.57
• CAS Registry Number: 73005-06-8
• SMILES: C3=C(N(C1(C(OC)=O)CCN(CC1)CCC2=CC=CS2)C(=O)CC)C=CC=C3.O=C(O)C(=O)O
• InChI: 1S/C22H28N2O3S.C2H2O4/c1-3-20(25)24(18-8-5-4-6-9-18)22(21(26)27-2)12-15-23(16-13-22)14-11-19-10-7-17-28-19;3-1(4)2(5)6/h4-10,17H,3,11-16H2,1-2H3;(H,3,4)(H,5,6)
• InChIKey: BABZHNGIRGHXSO-UHFFFAOYSA-N

Properties

• Boiling point: 509.5°C at 760 mmHg (Cal.)
• Flash point: 262°C (Cal.)