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203798-30-5,MFCD11868497
Catalog No.:AA00J8JD

203798-30-5 | (S)-3-Methyl-2-(3-oxobenzo[d]isothiazol-2(3H)-yl)butanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
in stock  
$212.00   $148.00
- +
500mg
in stock  
$470.00   $329.00
- +
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Technical Information
Catalog Number:
AA00J8JD
Chemical Name:
(S)-3-Methyl-2-(3-oxobenzo[d]isothiazol-2(3H)-yl)butanoic acid
CAS Number:
203798-30-5
Molecular Formula:
C12H13NO3S
Molecular Weight:
251.3015
MDL Number:
MFCD11868497
SMILES:
CC([C@H](n1sc2c(c1=O)cccc2)C(=O)O)C
Properties
Computed Properties
 
Complexity:
332  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.4  

Literature
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Additional Info:
SDS
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Tags:203798-30-5 Molecular Formula|203798-30-5 MDL|203798-30-5 SMILES|203798-30-5 (S)-3-Methyl-2-(3-oxobenzo[d]isothiazol-2(3H)-yl)butanoic acid