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956568-49-3,MFCD08166703
Catalog No.:AA019K0Q

956568-49-3 | ([4-Formyl-3-methyl-1-(4-methylbenzyl)-1h-pyrazol-5-yl]thio)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
94%
3 weeks  
$167.00   $117.00
- +
100mg
94%
3 weeks  
$190.00   $133.00
- +
250mg
94%
3 weeks  
$224.00   $157.00
- +
500mg
94%
3 weeks  
$308.00   $215.00
- +
1g
94%
3 weeks  
$417.00   $292.00
- +
2.5g
94%
3 weeks  
$708.00   $495.00
- +
5g
94%
3 weeks  
$995.00   $697.00
- +
10g
94%
3 weeks  
$1,424.00   $997.00
- +
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Technical Information
Catalog Number:
AA019K0Q
Chemical Name:
([4-Formyl-3-methyl-1-(4-methylbenzyl)-1h-pyrazol-5-yl]thio)acetic acid
CAS Number:
956568-49-3
Molecular Formula:
C15H16N2O3S
Molecular Weight:
304.3641
MDL Number:
MFCD08166703
SMILES:
O=Cc1c(C)nn(c1SCC(=O)O)Cc1ccc(cc1)C
Properties
Computed Properties
 
Complexity:
372  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
XLogP3:
2.5  

Literature
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Additional Info:
SDS
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Tags:956568-49-3 Molecular Formula|956568-49-3 MDL|956568-49-3 SMILES|956568-49-3 ([4-Formyl-3-methyl-1-(4-methylbenzyl)-1h-pyrazol-5-yl]thio)acetic acid