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Salbutamol Hemisulfate
[CAS# 36519-31-0]

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Identification
Name Salbutamol Hemisulfate
Synonyms 4-[2-(Tert-Butylamino)-1-Hydroxy-Ethyl]-2-(Hydroxymethyl)Phenol; Sulfuric Acid; 4-[2-(Tert-Butylamino)-1-Hydroxy-Ethyl]-2-Methylol-Phenol; Sulfuric Acid; Proventil (Tn)
Molecular Structure CAS#: 36519-31-0, Salbutamol Hemisulfate
Molecular Formula C26H44N2O10S
Molecular Weight 576.70
CAS Registry Number 36519-31-0
SMILES C1=C(C(=CC=C1C(CNC(C)(C)C)O)O)CO.C2=C(C(=CC=C2C(CNC(C)(C)C)O)O)CO.O=[S](O)(O)=O
InChI 1S/2C13H21NO3.H2O4S/c2*1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15;1-5(2,3)4/h2*4-6,12,14-17H,7-8H2,1-3H3;(H2,1,2,3,4)
InChIKey BNPSSFBOAGDEEL-UHFFFAOYSA-N
Properties
Melting point 180°C (Expl.)
solubility Soluble to 100 mM in water
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