Home Carboxys 1-(2,4-difluorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylic acid

1-(2,4-difluorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylic acid

CAS No.:
1152604-44-8
Catalog Number:
AG01AL0A
Molecular Formula:
C10H6F2N2O3
Molecular Weight:
240.1630
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Product Description
Catalog Number:
AG01AL0A
Chemical Name:
1-(2,4-difluorophenyl)-4-hydroxy-1H-pyrazole-3-carboxylic acid
CAS Number:
1152604-44-8
Molecular Formula:
C10H6F2N2O3
Molecular Weight:
240.1630
MDL Number:
MFCD11133577
IUPAC Name:
1-(2,4-difluorophenyl)-4-hydroxypyrazole-3-carboxylic acid
InChI:
InChI=1S/C10H6F2N2O3/c11-5-1-2-7(6(12)3-5)14-4-8(15)9(13-14)10(16)17/h1-4,15H,(H,16,17)
InChI Key:
VNRMGIYUWUEYEC-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)F)n1cc(c(n1)C(=O)O)O
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.035g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
240.166g/mol
Monoisotopic Mass:
240.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties