128694-63-3 | 1-Methyl-3-(trifluoromethyl)-1h-pyrazole-5-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
100mg	97%	in stock	$20.00	$14.00
250mg	97%	in stock	$24.00	$17.00
1g	95%	in stock	$54.00	$38.00

Description

• Catalog Number: AA44289
• Chemical Name: 1-Methyl-3-(trifluoromethyl)-1h-pyrazole-5-carboxylic acid
• CAS Number: 128694-63-3
• Molecular Formula: C6H5F3N2O2
• Molecular Weight: 194.1113
• MDL Number: MFCD02090853
• SMILES: OC(=O)c1cc(nn1C)C(F)(F)F

Computed Properties

• Complexity: 218
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 6
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1

Literature

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

  Bioorganic & medicinal chemistry letters 20101101

• Microsphere-based protease assays and screening application for lethal factor and factor Xa.

  Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501