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6-methylergoline-8beta-carboxylic acid Structure

6-methylergoline-8beta-carboxylic acid

Chemical Properties

Melting point 300 °C
Boiling point 517.3±50.0 °C(Predicted)
Density  1.310±0.06 g/cm3(Predicted)
solubility  DMSO (Slightly), Methanol (Slightly), Pyridine (Slightly)
form  Solid
pka 3.81±0.20(Predicted)
color  Pale Grey to Light Purple
Stability Hygroscopic
InChI InChI=1/C16H18N2O2/c1-18-8-10(16(19)20)5-12-11-3-2-4-13-15(11)9(7-17-13)6-14(12)18/h2-4,7,10,12,14,17H,5-6,8H2,1H3,(H,19,20)/t10-,12-,14-/s3
InChIKey ORBSYPFBZQJNJE-ZEQFDAOSNA-N
SMILES CN1C[C@H](C(=O)O)C[C@]2([H])C3=CC=CC4NC=C(C3=4)C[C@@]12[H] |&1:3,8,20,r|

Usage And Synthesis

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