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4684-28-0,MFCD22666251
Catalog No.:AA00DEWT

4684-28-0 | [7(S)-(1alpha,.2beta,4beta,5alpha,7beta)]-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl (hydroxymethyl)phenylacetate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
97.0%
2 weeks  
$1,027.00   $719.00
- +
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00DEWT
Chemical Name:
[7(S)-(1alpha,.2beta,4beta,5alpha,7beta)]-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl (hydroxymethyl)phenylacetate
CAS Number:
4684-28-0
Molecular Formula:
C16H19NO4
Molecular Weight:
289.3264
MDL Number:
MFCD22666251
SMILES:
OC[C@H](c1ccccc1)C(=O)O[C@@H]1C[C@@H]2N[C@H](C1)[C@@H]1[C@H]2O1
Properties
Computed Properties
 
Complexity:
393  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
5  
XLogP3:
0.9  

Literature

Title: Liquid chromatography-electrospray ionization ion trap mass spectrometry for analysis of in vivo and in vitro metabolites of scopolamine in rats.

Journal: Journal of chromatographic science 20080101

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SDS
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Tags:4684-28-0 Molecular Formula|4684-28-0 MDL|4684-28-0 SMILES|4684-28-0 [7(S)-(1alpha,.2beta,4beta,5alpha,7beta)]-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl (hydroxymethyl)phenylacetate