Home Other Building Blocks 5-Fluoronicotinic acid

5-Fluoronicotinic acid

CAS No.:
402-66-4
Catalog Number:
AG00349W
Molecular Formula:
C6H4FNO2
Molecular Weight:
141.0999
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$10
- +
5g
95%
In Stock USA
United States
$14
- +
25g
95%
In Stock USA
United States
$63
- +
100g
95%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG00349W
Chemical Name:
5-Fluoronicotinic acid
CAS Number:
402-66-4
Molecular Formula:
C6H4FNO2
Molecular Weight:
141.0999
MDL Number:
MFCD01318537
IUPAC Name:
5-fluoropyridine-3-carboxylic acid
InChI:
InChI=1S/C6H4FNO2/c7-5-1-4(6(9)10)2-8-3-5/h1-3H,(H,9,10)
InChI Key:
BXZSBDDOYIWMGC-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(F)cnc1
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.023g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
141.101g/mol
Monoisotopic Mass:
141.023g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
Title Journal
Agonist lead identification for the high affinity niacin receptor GPR109a. Bioorganic & medicinal chemistry letters 20070901
Properties