But-2-Enedioic Acid, 3-[3-(2-Methoxyphenoxy)Pyrrolidin-1-Yl]Propyl N-Phenylcarbamate
[CAS# 23044-19-1]

Identification

• Name: But-2-Enedioic Acid, 3-[3-(2-Methoxyphenoxy)Pyrrolidin-1-Yl]Propyl N-Phenylcarbamate
• Synonyms: But-2-Enedioic Acid; N-Phenylcarbamic Acid 3-[3-(2-Methoxyphenoxy)-1-Pyrrolidinyl]Propyl Ester; N-Phenylcarbamic Acid 3-[3-(2-Methoxyphenoxy)-1-Pyrrolidinyl]Propyl Ester; But-2-Enedioic Acid; N-Phenylcarbamic Acid 3-[3-(2-Methoxyphenoxy)Pyrrolidin-1-Yl]Propyl Ester; N-Phenylcarbamic Acid 3-[3-(2-Methoxyphenoxy)Pyrrolidin-1-Yl]Propyl Ester
• Molecular Formula: C₄₆H₅₆N₄O₁₂
• Molecular Weight: 856.97
• CAS Registry Number: 23044-19-1
• SMILES: C3=C(OC1CN(CC1)CCCOC(=O)NC2=CC=CC=C2)C(=CC=C3)OC.C6=C(OC4CN(CC4)CCCOC(=O)NC5=CC=CC=C5)C(=CC=C6)OC.O=C(O)\C=C\C(=O)O
• InChI: 1S/2C21H26N2O4.C4H4O4/c2*1-25-19-10-5-6-11-20(19)27-18-12-14-23(16-18)13-7-15-26-21(24)22-17-8-3-2-4-9-17;5-3(6)1-2-4(7)8/h2*2-6,8-11,18H,7,12-16H2,1H3,(H,22,24);1-2H,(H,5,6)(H,7,8)/b;;2-1+
• InChIKey: LMUDCRGXKHSTHA-WXXKFALUSA-N

Properties

• Boiling point: 480.9°C at 760 mmHg (Cal.)
• Flash point: 244.6°C (Cal.)