200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1158763-52-0
1158763-52-0 | 2-Pyridinecarboxylic acid, 5-[2-(trifluoromethyl)phenyl]-
CAS No: 1158763-52-0 Catalog No: AG000H0O MDL No:MFCD12406461
Product Description
Catalog Number:
AG000H0O
Chemical Name:
2-Pyridinecarboxylic acid, 5-[2-(trifluoromethyl)phenyl]-
CAS Number:
1158763-52-0
Molecular Formula:
C13H8F3NO2
Molecular Weight:
267.2033
MDL Number:
MFCD12406461
IUPAC Name:
5-[2-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
InChI:
InChI=1S/C13H8F3NO2/c14-13(15,16)10-4-2-1-3-9(10)8-5-6-11(12(18)19)17-7-8/h1-7H,(H,18,19)
InChI Key:
DNOFIVFIIQGFPD-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cn1)c1ccccc1C(F)(F)F
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.051g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.207g/mol
Monoisotopic Mass:
267.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.