Home Other Building Blocks 5-(3-Fluorophenyl)nicotinic acid

5-(3-Fluorophenyl)nicotinic acid

CAS No.:
181705-88-4
Catalog Number:
AG00231W
Molecular Formula:
C12H8FNO2
Molecular Weight:
217.1958
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$150
- +
5g
97%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00231W
Chemical Name:
5-(3-Fluorophenyl)nicotinic acid
CAS Number:
181705-88-4
Molecular Formula:
C12H8FNO2
Molecular Weight:
217.1958
MDL Number:
MFCD06410259
IUPAC Name:
5-(3-fluorophenyl)pyridine-3-carboxylic acid
InChI:
InChI=1S/C12H8FNO2/c13-11-3-1-2-8(5-11)9-4-10(12(15)16)7-14-6-9/h1-7H,(H,15,16)
InChI Key:
JARUBMHXTMGGFA-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)c1cncc(c1)C(=O)O
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.054g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
217.199g/mol
Monoisotopic Mass:
217.054g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties