But-2-Enedioic Acid, 1-Methoxy-9-[2-(1-Piperidyl)Ethyl]-5,6,7,8-Tetrahydrocarbazole
[CAS# 49558-40-9]

Identification

• Name: But-2-Enedioic Acid, 1-Methoxy-9-[2-(1-Piperidyl)Ethyl]-5,6,7,8-Tetrahydrocarbazole
• Synonyms: But-2-Enedioic Acid; 8-Methoxy-9-[2-(1-Piperidyl)Ethyl]-1,2,3,4-Tetrahydrocarbazole; But-2-Enedioic Acid; 8-Methoxy-9-(2-Piperidinoethyl)-1,2,3,4-Tetrahydrocarbazole; 1H-Carbazole, 2,3,4,9-Tetrahydro-8-Methoxy-9-(2-(1-Piperidinyl)Ethyl)-, (E)-2-Butenedioate (1:1)
• Molecular Formula: C₂₄H₃₂N₂O₅
• Molecular Weight: 428.53
• CAS Registry Number: 49558-40-9
• SMILES: C1=CC=C(OC)C2=C1C4=C([N]2CCN3CCCCC3)CCCC4.O=C(O)\C=C\C(=O)O
• InChI: 1S/C20H28N2O.C4H4O4/c1-23-19-11-7-9-17-16-8-3-4-10-18(16)22(20(17)19)15-14-21-12-5-2-6-13-21;5-3(6)1-2-4(7)8/h7,9,11H,2-6,8,10,12-15H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
• InChIKey: LADACSSZPGFAIO-WLHGVMLRSA-N

Properties

• Boiling point: 487.1°C at 760 mmHg (Cal.)
• Flash point: 248.4°C (Cal.)