1,3-Dihydro-3-Methyl-3-Phenyl-1-(1-Piperidinylmethyl)-2H-Indol-2-One (Z)-2-Butenedioate
[CAS# 37129-45-6]

Identification

• Name: 1,3-Dihydro-3-Methyl-3-Phenyl-1-(1-Piperidinylmethyl)-2H-Indol-2-One (Z)-2-Butenedioate
• Synonyms: But-2-Enedioic Acid; 3-Methyl-3-Phenyl-1-(1-Piperidylmethyl)Indolin-2-One; But-2-Enedioic Acid; 3-Methyl-3-Phenyl-1-(1-Piperidylmethyl)-2-Indolinone; But-2-Enedioic Acid; 3-Methyl-3-Phenyl-1-(Piperidinomethyl)Oxindole
• Molecular Formula: C₂₅H₂₈N₂O₅
• Molecular Weight: 436.51
• CAS Registry Number: 37129-45-6
• SMILES: C1=CC=CC2=C1C(C(=O)N2CN3CCCCC3)(C4=CC=CC=C4)C.O=C(O)\C=C\C(=O)O
• InChI: 1S/C21H24N2O.C4H4O4/c1-21(17-10-4-2-5-11-17)18-12-6-7-13-19(18)23(20(21)24)16-22-14-8-3-9-15-22;5-3(6)1-2-4(7)8/h2,4-7,10-13H,3,8-9,14-16H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: VJJPMBLTEUZRLG-WLHGVMLRSA-N

Properties

• Boiling point: 503.5°C at 760 mmHg (Cal.)
• Flash point: 221.4°C (Cal.)