Home Carboxys 1H-Pyrazole-4-carboxylic acid, 1-(2-fluorophenyl)-

1H-Pyrazole-4-carboxylic acid, 1-(2-fluorophenyl)-

CAS No.:
1134310-63-6
Catalog Number:
AG0008JQ
Molecular Formula:
C10H7FN2O2
Molecular Weight:
206.1732
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Product Description
Catalog Number:
AG0008JQ
Chemical Name:
1H-Pyrazole-4-carboxylic acid, 1-(2-fluorophenyl)-
CAS Number:
1134310-63-6
Molecular Formula:
C10H7FN2O2
Molecular Weight:
206.1732
MDL Number:
MFCD09950609
IUPAC Name:
1-(2-fluorophenyl)pyrazole-4-carboxylic acid
InChI:
InChI=1S/C10H7FN2O2/c11-8-3-1-2-4-9(8)13-6-7(5-12-13)10(14)15/h1-6H,(H,14,15)
InChI Key:
DDVNOGMFQMGSFY-UHFFFAOYSA-N
SMILES:
Fc1ccccc1n1ncc(c1)C(=O)O
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.049g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.176g/mol
Monoisotopic Mass:
206.049g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties