3-Methyl-2-Phenylvaleroyl 1-Methyl-4-Piperidyl Fumarate
[CAS# 635-32-5]

Identification

• Name: 3-Methyl-2-Phenylvaleroyl 1-Methyl-4-Piperidyl Fumarate
• Synonyms: (1-Methyl-4-Piperidyl) (3-Methyl-2-Phenyl-Pentanoyl) (E)-But-2-Enedioate; (E)-But-2-Enedioic Acid (1-Methyl-4-Piperidinyl) Ester (3-Methyl-1-Oxo-2-Phenylpentyl) Ester; (E)-But-2-Enedioic Acid (1-Methyl-4-Piperidyl) Ester (3-Methyl-2-Phenyl-Pentanoyl) Ester
• Molecular Formula: C₂₂H₂₉NO₅
• Molecular Weight: 387.47
• CAS Registry Number: 635-32-5
• EINECS: 211-233-4
• SMILES: C2=C(C(C(OC(=O)\C=C\C(OC1CCN(CC1)C)=O)=O)C(CC)C)C=CC=C2
• InChI: 1S/C22H29NO5/c1-4-16(2)21(17-8-6-5-7-9-17)22(26)28-20(25)11-10-19(24)27-18-12-14-23(3)15-13-18/h5-11,16,18,21H,4,12-15H2,1-3H3/b11-10+
• InChIKey: NSUBNYZSJGLUCC-ZHACJKMWSA-N

Properties

• Density: 1.148g/cm³ (Cal.)
• Boiling point: 511.794°C at 760 mmHg (Cal.)
• Flash point: 263.324°C (Cal.)