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Vecuronium Bromide

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Vecuronium Bromide / CAS : 50700-72-6

Appearance White or off white crystalline powder UN 0.0
HS 2933360000 DG Class 0.0
Synonyms Vecuronium Bromide Hydrate; 1-(3Alpha,17beta-Dihydroxy-2beta-Piperidino-5Alpha-Androstan-16beta,5Alpha-yl)-1-Methylpiperidinium Bromide, Diacetate; (+)-1-(3,17-Diacetoxy-2-Piperidino-5-Androstan-16-yl)-1-Methylpiperidinium Bromide
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Properties

Summary

Formula
C34H57BrN2O4
Molecular Mass
637.73100
Exact Mass
636.35000
PSA
55.84000
Logp
2.86660
IUPAC
[(2S,3S,5S,8R,9S,10S,13S,14S,16S,17R)-17-acetyloxy-10,13-dimethyl-16-(1-methylpiperidin-1-ium-1-yl)-2-piperidin-1-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate;bromide
SMILES
CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1N4CCCCC4)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C.[Br-]

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials

Chemical and Physical Properties

Melting Point
227-229°C
Appearance
White or off white crystalline powder

Export information

HS Code
2933360000
Export Rebate
13%
UN No.
0.0
DG-Class
0.0
Risk Code
R36/37/38
Safety Label
Xi

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