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Rocuronium Bromide

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Rocuronium Bromide / CAS : 119302-91-9

Appearance white to gray-white powder UN 0.0
HS 2934999099 DG Class 0.0
Synonyms Rocuroniun Bromide; Zemu; Zemuron,Esmeron; 1-[(2B,3A,5A,16B,17B)-17-(Acetyloxy)-3-Hydroxy-2-(4-Morpholinyl)Androstan-16-Yl]-1-(2-Propenyl)Pyrrolidinium Bromide; [3-Hydroxy-10,13-Dimethyl-2-Morpholin-4-Yl-16-(1-Prop-2-Enyl-2,3,4,5-Tetrahydropyrrol-1-Yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl] Acetate Bromide
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Properties

Summary

Formula
C32H53BrN2O4
Molecular Mass
609.67800
Exact Mass
608.31900
PSA
59.00000
Logp
1.30820
IUPAC
[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-3-hydroxy-10,13-dimethyl-2-morpholin-4-yl-16-(1-prop-2-enylpyrrolidin-1-ium-1-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate;bromide
SMILES
CC(=O)O[C@H]1[C@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(C[C@@H]([C@H](C4)O)N5CCOCC5)C)C)[N+]6(CCCC6)CC=C.[Br-]

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials

Chemical and Physical Properties

Melting Point
162-1640℃
Appearance
white to gray-white powder

Export information

HS Code
2934999099
Export Rebate
13%
UN No.
0.0
DG-Class
0.0

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