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Product Information
Analyte Data
Analyte Name
Atropine sulfate hydrate
CAS Number
5908-99-6
Molecular Formula
2 C17 H23 N O3 . H2 O . H2 O4 S
Molecular Weight
694.83
Accurate Mass
694.3135
Flash Point
5.0
SMILES
O.CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)[C@@H](CO)c3ccccc3.CN4[C@@H]5CC[C@H]4C[C@H](C5)OC(=O)[C@@H](CO)c6ccccc6.OS(=O)(=O)O
InChI
1-5(2,3)4, InChI=1S/2C17H23NO3.H2O4S.H2O/c2*1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12, /h2*2-6,13-16,19H,7-11H2,1H3, /m00../s1, 1H2/t2*13-,14+,15+,16-, (H2,1,2,3,4),
IUPAC
[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] (2R)-3-hydroxy-2-phenylpropanoate;sulfuric acid;hydrate
Alternate CAS Number
Free base: 51-55-8
Product Data
Storage Temperature
2-8C Fridge/Coldroom
Shipping Temperature
Room Temperature
Country of Origin
FRANCE
Tariff Code
29398000
Product Type
API
Product Format
Neat
API Family
Analytical Method
Monograph only
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