Home Other Building Blocks 5-(Trifluoromethyl)nicotinic acid

5-(Trifluoromethyl)nicotinic acid

CAS No.:
131747-40-5
Catalog Number:
AG000ZNC
Molecular Formula:
C7H4F3NO2
Molecular Weight:
191.1074
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$213
- +
10g
98%
In Stock USA
United States
$394
- +
25g
98%
In Stock USA
United States
$694
- +
Product Description
Catalog Number:
AG000ZNC
Chemical Name:
5-(Trifluoromethyl)nicotinic acid
CAS Number:
131747-40-5
Molecular Formula:
C7H4F3NO2
Molecular Weight:
191.1074
MDL Number:
MFCD07774128
IUPAC Name:
5-(trifluoromethyl)pyridine-3-carboxylic acid
InChI:
InChI=1S/C7H4F3NO2/c8-7(9,10)5-1-4(6(12)13)2-11-3-5/h1-3H,(H,12,13)
InChI Key:
RKFDCELCLIZRRH-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc(c1)C(F)(F)F
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.019g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.109g/mol
Monoisotopic Mass:
191.019g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties