200,000+ products from a single source!
sales@angenechem.com
131747-40-5 | 3-Pyridinecarboxylic acid, 5-(trifluoromethyl)-
CAS No: 131747-40-5 Catalog No: AG000ZNC MDL No:MFCD07774128
Product Description
Catalog Number:
AG000ZNC
Chemical Name:
3-Pyridinecarboxylic acid, 5-(trifluoromethyl)-
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
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.