Home Other Building Blocks 3-fluoro-4-(1H-pyrazol-1-yl)benzoic acid

3-fluoro-4-(1H-pyrazol-1-yl)benzoic acid

CAS No.:
1152868-16-0
Catalog Number:
AG01AAXZ
Molecular Formula:
C10H7FN2O2
Molecular Weight:
206.1732
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AAXZ
Chemical Name:
3-fluoro-4-(1H-pyrazol-1-yl)benzoic acid
CAS Number:
1152868-16-0
Molecular Formula:
C10H7FN2O2
Molecular Weight:
206.1732
MDL Number:
MFCD11156561
IUPAC Name:
3-fluoro-4-pyrazol-1-ylbenzoic acid
InChI:
InChI=1S/C10H7FN2O2/c11-8-6-7(10(14)15)2-3-9(8)13-5-1-4-12-13/h1-6H,(H,14,15)
InChI Key:
GMPXSUOBBQQHAC-UHFFFAOYSA-N
SMILES:
Fc1cc(ccc1n1cccn1)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