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692287-51-7,MFCD03102586
Catalog No.:AA00IYJJ

692287-51-7 | (2E)-3-(2H-1,3-benzodioxol-5-yl)-1-[4-(1H-1,2,4-triazol-1-yl)phenyl]prop-2-en-1-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$281.00   $197.00
- +
5mg
>90%
1 week  
$297.00   $208.00
- +
10mg
>90%
1 week  
$327.00   $229.00
- +
500mg
>90%
1 week  
$902.00   $632.00
- +
1g
>90%
1 week  
$1,590.00   $1,113.00
- +
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Technical Information
Catalog Number:
AA00IYJJ
Chemical Name:
(2E)-3-(2H-1,3-benzodioxol-5-yl)-1-[4-(1H-1,2,4-triazol-1-yl)phenyl]prop-2-en-1-one
CAS Number:
692287-51-7
Molecular Formula:
C18H13N3O3
Molecular Weight:
319.3141
MDL Number:
MFCD03102586
SMILES:
O=C(c1ccc(cc1)n1cncn1)/C=C/c1ccc2c(c1)OCO2
Properties
Computed Properties
 
Complexity:
476  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
4  
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.2  

Literature
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Additional Info:
SDS
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Tags:692287-51-7 Molecular Formula|692287-51-7 MDL|692287-51-7 SMILES|692287-51-7 (2E)-3-(2H-1,3-benzodioxol-5-yl)-1-[4-(1H-1,2,4-triazol-1-yl)phenyl]prop-2-en-1-one