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Home Other Building Blocks 2-(4-Chlorophenyl)-5-methyl-1H-pyrazol-3(2H)-one

2-(4-Chlorophenyl)-5-methyl-1H-pyrazol-3(2H)-one

CAS No.:
13024-90-3
Catalog Number:
AG000U6X
Molecular Formula:
C10H9ClN2O
Molecular Weight:
208.6443
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
>98.0%(T)
1 week
United States
$75
- +
500g
>98.0%(T)
1 week
United States
$363
- +
Product Description
Catalog Number:
AG000U6X
Chemical Name:
2-(4-Chlorophenyl)-5-methyl-1H-pyrazol-3(2H)-one
CAS Number:
13024-90-3
Molecular Formula:
C10H9ClN2O
Molecular Weight:
208.6443
MDL Number:
MFCD00043814
IUPAC Name:
2-(4-chlorophenyl)-5-methyl-4H-pyrazol-3-one
InChI:
InChI=1S/C10H9ClN2O/c1-7-6-10(14)13(12-7)9-4-2-8(11)3-5-9/h2-5H,6H2,1H3
InChI Key:
WHIXQFSPEDIMGL-UHFFFAOYSA-N
SMILES:
O=C1CC(=NN1c1ccc(cc1)Cl)C
EC Number:
235-884-9
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.645g/mol
Monoisotopic Mass:
208.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
New series of antiprion compounds: pyrazolone derivatives have the potent activity of inhibiting protease-resistant prion protein accumulation. Journal of medicinal chemistry 20071018
High-throughput assay for the identification of Hsp90 inhibitors based on Hsp90-dependent refolding of firefly luciferase. Bioorganic & medicinal chemistry 20070301
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
Properties