Home Carboxys 1-(3,5-difluorophenyl)-1H-pyrazole-3-carboxylic acid

1-(3,5-difluorophenyl)-1H-pyrazole-3-carboxylic acid

CAS No.:
1152534-38-7
Catalog Number:
AG01BIE7
Molecular Formula:
C10H6F2N2O2
Molecular Weight:
224.1636
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BIE7
Chemical Name:
1-(3,5-difluorophenyl)-1H-pyrazole-3-carboxylic acid
CAS Number:
1152534-38-7
Molecular Formula:
C10H6F2N2O2
Molecular Weight:
224.1636
MDL Number:
MFCD10693430
IUPAC Name:
1-(3,5-difluorophenyl)pyrazole-3-carboxylic acid
InChI:
InChI=1S/C10H6F2N2O2/c11-6-3-7(12)5-8(4-6)14-2-1-9(13-14)10(15)16/h1-5H,(H,15,16)
InChI Key:
KZECBNPKDMPAEC-UHFFFAOYSA-N
SMILES:
Fc1cc(F)cc(c1)n1ccc(n1)C(=O)O
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.04g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
224.167g/mol
Monoisotopic Mass:
224.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties