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345637-71-0,MFCD00297315
Catalog No.:AA007ETB

345637-71-0 | (5-Methyl-3-trifluoromethyl-pyrazol-1-yl)-acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
in stock  
$43.00   $30.00
- +
1g
≥ 95% (HPLC)
in stock  
$428.00   $299.00
- +
5g
≥ 95% (HPLC)
in stock  
$1,729.00   $1,210.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA007ETB
Chemical Name:
(5-Methyl-3-trifluoromethyl-pyrazol-1-yl)-acetic acid
CAS Number:
345637-71-0
Molecular Formula:
C7H7F3N2O2
Molecular Weight:
208.1379
MDL Number:
MFCD00297315
SMILES:
OC(=O)Cn1nc(cc1C)C(F)(F)F
Properties
Computed Properties
 
Complexity:
232  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.2  

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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SDS
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Tags:345637-71-0 Molecular Formula|345637-71-0 MDL|345637-71-0 SMILES|345637-71-0 (5-Methyl-3-trifluoromethyl-pyrazol-1-yl)-acetic acid
Catalog No.: AA007ETB
345637-71-0,MFCD00297315
345637-71-0 | (5-Methyl-3-trifluoromethyl-pyrazol-1-yl)-acetic acid
Pack Size： 100mg
Purity：
in stock
$43.00 $30.00
Pack Size： 1g
Purity： ≥ 95% (HPLC)
in stock
$428.00 $299.00
Pack Size： 5g
Purity： ≥ 95% (HPLC)
in stock
$1,729.00 $1,210.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA007ETB
Chemical Name: (5-Methyl-3-trifluoromethyl-pyrazol-1-yl)-acetic acid
CAS Number: 345637-71-0
Molecular Formula: C7H7F3N2O2
Molecular Weight: 208.1379
MDL Number: MFCD00297315
SMILES: OC(=O)Cn1nc(cc1C)C(F)(F)F
Properties
Complexity: 232  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.2  
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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