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Methylergonovine

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Methylergonovine / CAS : 113-42-8

Appearance - UN 0
HS 0 DG Class 0
Synonyms Methylergobasine; Prestwick_727; Methylergometrin; Methylergometrine; Methylergobrevin; 9,10-Didehydo-N-[(S)-1-(Hydroxymethyl)Propyl]-6-Methylergoline-8β-Carboxamide; [8β(S)]-9,10-Didehydro-N-[1-(Hydroxymethyl)Propyl]-6-Methylergoline-8-Carboxamidemaleate; N-[Alpha-(Hydroxymethyl)Propyl]-D-Lysergamide; Partergin
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Properties

Summary

Formula
C20H25N3O2
Molecular Mass
339.43100
Exact Mass
339.19500
PSA
68.36000
Logp
2.25350
IUPAC
(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
SMILES
CCC(CO)NC(=O)C1CN(C2CC3=CNC4=CC=CC(=C34)C2=C1)C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Melting Point
172ºC
Density
1.28 g/cm3
Boiling Point
638.4ºC at 760 mmHg
Flash Point
339.9ºC

Export information

HS Code
0
UN No.
0
DG-Class
0

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