(8alpha)-9,10-Didehydro-N,N-Diethyl-6-Methylergoline-8-Carboxamide
[CAS# 2126-78-5]

Identification

• Classification: Analytical chemistry >> Standard >> Standard material
• Name: (8alpha)-9,10-Didehydro-N,N-Diethyl-6-Methylergoline-8-Carboxamide
• Synonyms: Ergoline-8-Carboxamide, 9,10-Didehydro-N,N-Diethyl-6-Methyl-, (8Alpha)-
• Molecular Formula: C₂₀H₂₅N₃O
• Molecular Weight: 323.44
• CAS Registry Number: 2126-78-5
• SMILES: [C@H]4(C(N(CC)CC)=O)CN(C)C3CC1=C[NH]C2=C1C(=CC=C2)C3=C4
• InChI: 1S/C20H25N3O/c1-4-23(5-2)20(24)14-9-16-15-7-6-8-17-19(15)13(11-21-17)10-18(16)22(3)12-14/h6-9,11,14,18,21H,4-5,10,12H2,1-3H3/t14-,18?/m1/s1
• InChIKey: VAYOSLLFUXYJDT-IKJXHCRLSA-N

Properties

• Density: 1.216g/cm³ (Cal.)
• Boiling point: 541.279°C at 760 mmHg (Cal.)
• Flash point: 281.156°C (Cal.)