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Dihydroergocristine Mesylate

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Dihydroergocristine Mesylate / CAS : 24730-10-7

Appearance White or almost white, fine crystalline powder UN UN 1544
HS 29396900 DG Class 6.1(b)
Synonyms Dihydroergocristine Methanesulphonate; Dihydroergocrystine Methanesulfonate Salt
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Properties

Summary

Formula
C36H45N5O8S
Molecular Mass
707.83600
Exact Mass
707.29900
PSA
180.96000
Logp
3.50660
IUPAC
(6aR,9R,10aR)-N-[(1S,2S,4R,7S)-7-benzyl-2-hydroxy-5,8-dioxo-4-propan-2-yl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;methanesulfonic acid
SMILES
CC(C)[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@@H]3[C@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@@H]5C[C@@H]6[C@H](CC7=CNC8=CC=CC6=C78)N(C5)C.CS(=O)(=O)O

Attribute classification

Category
Auxiliary > Other Auxiliary Agent

Chemical and Physical Properties

Melting Point
210 °C
Boiling Point
899.3ºC at 760 mmHg
Flash Point
497.7ºC
Appearance
White or almost white, fine crystalline powder

Export information

HS Code
29396900
Export Rebate
13%
UN No.
UN 1544
DG-Class
6.1(b)

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