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Home Amines 861211-20-3
861211-20-3,MFCD04124981
Catalog No.:AA00IXT0

861211-20-3 | methyl 6-amino-4-(2H-1,3-benzodioxol-5-yl)-5-cyano-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$299.00   $209.00
- +
5mg
>90%
1 week  
$319.00   $223.00
- +
10mg
>90%
1 week  
$358.00   $250.00
- +
500mg
>90%
1 week  
$1,087.00   $761.00
- +
1g
>90%
1 week  
$1,960.00   $1,372.00
- +
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Technical Information
Catalog Number:
AA00IXT0
Chemical Name:
methyl 6-amino-4-(2H-1,3-benzodioxol-5-yl)-5-cyano-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate
CAS Number:
861211-20-3
Molecular Formula:
C18H16N2O7
Molecular Weight:
372.3288
MDL Number:
MFCD04124981
SMILES:
COC(=O)C1=C(CC(=O)OC)OC(=C(C1c1ccc2c(c1)OCO2)C#N)N
Properties
Computed Properties
 
Complexity:
748  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.3  

Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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Tags:861211-20-3 Molecular Formula|861211-20-3 MDL|861211-20-3 SMILES|861211-20-3 methyl 6-amino-4-(2H-1,3-benzodioxol-5-yl)-5-cyano-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate