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Methyl 9,10-didehydro-6-methylergoline-8beta-carboxylate
[CAS# 4579-64-0]

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Identification
NameMethyl 9,10-didehydro-6-methylergoline-8beta-carboxylate
Molecular StructureCAS # 4579-64-0, Methyl 9,10-didehydro-6-methylergoline-8beta-carboxylate
Molecular FormulaC17H18N2O2
Molecular Weight282.34
CAS Registry Number4579-64-0
EC Number224-964-9
SMILESCN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)OC
Properties
Solubility182.5 mg/L (25 °C water)
Density1.3±0.1 g/cm3, Calc.*
Index of Refraction1.671, Calc.*
Melting point170.22 °C
Boiling Point418.99 °C, 469.0±45.0 °C (760 mmHg), Calc.*
Flash Point237.5±28.7 °C, Calc.*
*Calculated using Advanced Chemistry Development (ACD/Labs) Software.
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