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Product Overview

Product Code

EPA1400000

CAS Number

5908-99-6

Product Format

Neat

Regulatory Method

Monograph only

Molecular Formula

2C17H23NO3.H2O4S.H2O

Molecular Weight

694.83

API Family

Atropine

Product Type

API

Alternate CAS Number

Free base: 51-55-8

Analytical Method

Monograph only

Documentation

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Product Information

Analyte Data

Analyte Name

Atropine sulfate hydrate

CAS Number

5908-99-6

Molecular Formula

2C17H23NO3.H2O4S.H2O

Molecular Weight

694.83

Accurate Mass

694.3135

Flash Point

5

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

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;1-5(2,3)4;/h2*2-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4);1H2/t2*13-,14+,15+,16-;;/m00../s1

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

+4°C

Shipping Temperature

Room Temperature

Country of Origin

FRANCE

Product Type

API

Product Format

Neat

API Family

Atropine

Analytical Method

Monograph only

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