1-Methyl-4-[Phenyl(Thien-2-Ylmethyl)Ammonio]Piperidinium Maleate
[CAS# 53892-20-9]

Identification

• Name: 1-Methyl-4-[Phenyl(Thien-2-Ylmethyl)Ammonio]Piperidinium Maleate
• Synonyms: But-2-Enedioic Acid; 1-Methyl-N-Phenyl-N-(2-Thienylmethyl)Piperidin-4-Amine; But-2-Enedioic Acid; 1-Methyl-N-Phenyl-N-(2-Thienylmethyl)-4-Piperidinamine; But-2-Enedioic Acid; (1-Methyl-4-Piperidyl)-Phenyl-(2-Thienylmethyl)Amine
• Molecular Formula: C₂₁H₂₆N₂O₄S
• Molecular Weight: 402.51
• CAS Registry Number: 53892-20-9
• EINECS: 258-844-2
• SMILES: C3=C(N(C1CCN(CC1)C)CC2=CC=CS2)C=CC=C3.O=C(O)\C=C/C(=O)O
• InChI: 1S/C17H22N2S.C4H4O4/c1-18-11-9-16(10-12-18)19(14-17-8-5-13-20-17)15-6-3-2-4-7-15;5-3(6)1-2-4(7)8/h2-8,13,16H,9-12,14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
• InChIKey: OYCQNZCKQWGYBZ-BTJKTKAUSA-N

Properties

• Boiling point: 413.9°C at 760 mmHg (Cal.)
• Flash point: 204.1°C (Cal.)