68113

2-{1-[(2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4-[2-(3-methoxyphenyl)-2-oxoethylthio]piperidin-3-ylidene}acetic acid hydrochloride

analytical standard

• Synonym(s): Prasugrel metabolite M3
• Empirical Formula (Hill Notation): C₂₇H₂₈FNO₅S · HCl
• CAS Number: 1287383-06-5
• Molecular Weight: 534.04
• MDL number: MFCD28118929
• UNSPSC Code: 41116107
• PubChem Substance ID: 329760745

Properties

• grade: analytical standard
• Assay: ≥97.0% (sum of diastereomers, HPLC)
• shelf life: limited shelf life, expiry date on the label
• technique(s): HPLC: suitable; gas chromatography (GC): suitable
• application(s): pharmaceutical
• format: neat
• storage temp.: −20°C
• SMILES string: O=C(C1CC1)C(N2CCC(SCC(C3=CC(OC)=CC=C3)=O)/C(C2)=C\C(O)=O)C4=CC=CC=C4F.Cl
• InChI: 1S/C27H28FNO5S.ClH/c1-34-20-6-4-5-18(13-20)23(30)16-35-24-11-12-29(15-19(24)14-25(31)32)26(27(33)17-9-10-17)21-7-2-3-8-22(21)28;/h2-8,13-14,17,24,26H,9-12,15-16H2,1H3,(H,31,32);1H/b19-14-;
• InChI key: IXPJVHUXCREIQM-YEBWQKSTSA-N

Description

Application

Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Safety Information

• Storage Class Code: 13 - Non Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable