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956986-59-7,MFCD07329987
Catalog No.:AA00IJA4

956986-59-7 | 2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]acetonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$204.00   $143.00
- +
100mg
95%
3 weeks  
$252.00   $177.00
- +
250mg
95%
3 weeks  
$311.00   $218.00
- +
500mg
95%
3 weeks  
$488.00   $342.00
- +
1g
95%
3 weeks  
$649.00   $454.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00IJA4
Chemical Name:
2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]acetonitrile
CAS Number:
956986-59-7
Molecular Formula:
C13H13N3
Molecular Weight:
211.2624
MDL Number:
MFCD07329987
SMILES:
N#CCc1ccc(cc1)n1nc(cc1C)C
Properties
Computed Properties
 
Complexity:
272  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
2.3  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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Tags:956986-59-7 Molecular Formula|956986-59-7 MDL|956986-59-7 SMILES|956986-59-7 2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]acetonitrile
Catalog No.: AA00IJA4
956986-59-7,MFCD07329987
956986-59-7 | 2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]acetonitrile
Pack Size： 50mg
Purity： 95%
3 weeks
$204.00 $143.00
Pack Size： 100mg
Purity： 95%
3 weeks
$252.00 $177.00
Pack Size： 250mg
Purity： 95%
3 weeks
$311.00 $218.00
Pack Size： 500mg
Purity： 95%
3 weeks
$488.00 $342.00
Pack Size： 1g
Purity： 95%
3 weeks
$649.00 $454.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00IJA4
Chemical Name: 2-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]acetonitrile
CAS Number: 956986-59-7
Molecular Formula: C13H13N3
Molecular Weight: 211.2624
MDL Number: MFCD07329987
SMILES: N#CCc1ccc(cc1)n1nc(cc1C)C
Properties
Complexity: 272  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 2  
Rotatable Bond Count: 2  
XLogP3: 2.3  
Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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