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Home Fluorides 99460-76-1
99460-76-1,MFCD04969059
Catalog No.:AA00J0TL

99460-76-1 | (5E)-2-Mercapto-5-[4-(trifluoromethyl)benzylidene]-1,3-thiazol-4(5h)-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$123.00   $86.00
- +
5g
95%
in stock  
$489.00   $343.00
- +
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Technical Information
Catalog Number:
AA00J0TL
Chemical Name:
(5E)-2-Mercapto-5-[4-(trifluoromethyl)benzylidene]-1,3-thiazol-4(5h)-one
CAS Number:
99460-76-1
Molecular Formula:
C11H6F3NOS2
Molecular Weight:
289.2966
MDL Number:
MFCD04969059
SMILES:
FC(c1ccc(cc1)/C=C\1/SC(=NC1=O)S)(F)F
Properties
Computed Properties
 
Complexity:
398  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3.7  

Literature
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Additional Info:
SDS
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Tags:99460-76-1 Molecular Formula|99460-76-1 MDL|99460-76-1 SMILES|99460-76-1 (5E)-2-Mercapto-5-[4-(trifluoromethyl)benzylidene]-1,3-thiazol-4(5h)-one