1-(4-Cyclopentylphenyl)-2-(4-morpholinyl)ethanol (2Z)-2-butenedioate (1:1)
[CAS# 85690-02-4]

Identification

• Name: 1-(4-Cyclopentylphenyl)-2-(4-morpholinyl)ethanol (2Z)-2-butenedioate (1:1)
• Synonyms: 4-Morpholineethanol, α-(4-cyclopentylphenyl)-, (Z)-2-butenedioate (1:1); α-(4-Cyclopentylphenyl)-4-morpholineethanol (Z)-2-butenedioate
• Molecular Formula: C₂₁H₂₉NO₆
• Molecular Weight: 391.46
• CAS Registry Number: 85690-02-4
• SMILES: O=C(O)\C=C/C(=O)O.OC(c1ccc(cc1)C2CCCC2)CN3CCOCC3
• InChI: 1S/C17H25NO2.C4H4O4/c19-17(13-18-9-11-20-12-10-18)16-7-5-15(6-8-16)14-3-1-2-4-14;5-3(6)1-2-4(7)8/h5-8,14,17,19H,1-4,9-13H2;1-2H,(H,5,6)(H,7,8)/b;2-1-
• InChIKey: CMIHAYRLHJZYNM-BTJKTKAUSA-N

Properties

• Boiling point: 433.3°C at 760 mmHg (Cal.)
• Flash point: 215.8°C (Cal.)