But-2-Enedioic Acid; 2-Dimethylaminoethyl 2-Cyclopentylhexanoate
[CAS# 129344-92-9]

Identification

• Name: But-2-Enedioic Acid; 2-Dimethylaminoethyl 2-Cyclopentylhexanoate
• Synonyms: But-2-Enedioic Acid; 2-Cyclopentylhexanoic Acid 2-Dimethylaminoethyl Ester; 2-(Dimethylamino)Ethyl Alpha-Butylcyclopentaneacetate (E)-2-Butenedioate (1:1); Cyclopentaneacetic Acid, Alpha-Butyl-, 2-(Dimethylamino)Ethyl Ester, (E)-2-Butenedioate (1:1)
• Molecular Formula: C₁₉H₃₃NO₆
• Molecular Weight: 371.47
• CAS Registry Number: 129344-92-9
• SMILES: C(C(C1CCCC1)C(OCCN(C)C)=O)CCC.O=C(O)\C=C\C(=O)O
• InChI: 1S/C15H29NO2.C4H4O4/c1-4-5-10-14(13-8-6-7-9-13)15(17)18-12-11-16(2)3;5-3(6)1-2-4(7)8/h13-14H,4-12H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: UCVPDWGSPZBNEO-WLHGVMLRSA-N

Properties

• Boiling point: 332.4°C at 760 mmHg (Cal.)
• Flash point: 102.8°C (Cal.)