But-2-Enedioic Acid, 1-(2-Methoxyphenyl)-7,8-Dioxa-3-Azabicyclo[3.2.1] Octane
[CAS# 84509-05-7]

Identification

• Name: But-2-Enedioic Acid, 1-(2-Methoxyphenyl)-7,8-Dioxa-3-Azabicyclo[3.2.1] Octane
• Synonyms: 5-(2-Methoxyphenyl)-6,8-Dioxa-3-Azabicyclo(3.2.1)Octane (Z)-2-Butenedioate (1:1); 6,8-Dioxa-3-Azabicyclo(3.2.1)Octane, 5-(2-Methoxyphenyl)-, (Z)-2-Butenedioate (1:1)
• Molecular Formula: C₁₆H₁₉NO₇
• Molecular Weight: 337.33
• CAS Registry Number: 84509-05-7
• SMILES: C3=C(C12OC(CO1)CNC2)C(=CC=C3)OC.O=C(O)\C=C\C(=O)O
• InChI: 1S/C12H15NO3.C4H4O4/c1-14-11-5-3-2-4-10(11)12-8-13-6-9(16-12)7-15-12;5-3(6)1-2-4(7)8/h2-5,9,13H,6-8H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: YYWZBLDGCWRZPM-WLHGVMLRSA-N

Properties

• Boiling point: 358.9°C at 760 mmHg (Cal.)
• Flash point: 142.1°C (Cal.)