2-(Dimethylamino)ethyl cycloheptaneacetate (E)-2-butenedioate (1:1)
[CAS# 129320-13-4]

Identification

• Name: 2-(Dimethylamino)ethyl cycloheptaneacetate (E)-2-butenedioate (1:1)
• Synonyms: But-2-Enedioic Acid; 2-Cycloheptylacetic Acid 2-Dimethylaminoethyl Ester; But-2-Enedioic Acid; 2-Dimethylaminoethyl 2-Cycloheptylethanoate; 2-(Dimethylamino)Ethyl Cycloheptaneacetate (E)-2-Butenedioate (1:1)
• Molecular Formula: C₁₇H₂₉NO₆
• Molecular Weight: 343.42
• CAS Registry Number: 129320-13-4
• SMILES: C(C1CCCCCC1)C(OCCN(C)C)=O.O=C(\C=C\C(O)=O)O
• InChI: 1S/C13H25NO2.C4H4O4/c1-14(2)9-10-16-13(15)11-12-7-5-3-4-6-8-12;5-3(6)1-2-4(7)8/h12H,3-11H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: ADRXUDOECUCYFV-WLHGVMLRSA-N

Properties

• Boiling point: 308°C at 760 mmHg (Cal.)
• Flash point: 102.6°C (Cal.)