Home Halogens 4-bromo-1-(4-fluorophenyl)-1H-pyrazole-3-carboxylic acid

4-bromo-1-(4-fluorophenyl)-1H-pyrazole-3-carboxylic acid

CAS No.:
1156392-56-1
Catalog Number:
AG01AJA6
Molecular Formula:
C10H6BrFN2O2
Molecular Weight:
285.0692
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Product Description
Catalog Number:
AG01AJA6
Chemical Name:
4-bromo-1-(4-fluorophenyl)-1H-pyrazole-3-carboxylic acid
CAS Number:
1156392-56-1
Molecular Formula:
C10H6BrFN2O2
Molecular Weight:
285.0692
MDL Number:
MFCD12181673
IUPAC Name:
4-bromo-1-(4-fluorophenyl)pyrazole-3-carboxylic acid
InChI:
InChI=1S/C10H6BrFN2O2/c11-8-5-14(13-9(8)10(15)16)7-3-1-6(12)2-4-7/h1-5H,(H,15,16)
InChI Key:
SFVBKMGQINVBER-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)n1cc(c(n1)C(=O)O)Br
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.96g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
285.072g/mol
Monoisotopic Mass:
283.96g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties