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773109-19-6

773109-19-6 | 3-Pyridinecarboxylicacid, 2,5,6-trifluoro-

CAS No: 773109-19-6 Catalog No: AG005CZB MDL No:

Product Description

Catalog Number:
AG005CZB
Chemical Name:
3-Pyridinecarboxylicacid, 2,5,6-trifluoro-
CAS Number:
773109-19-6
Molecular Formula:
C6H2F3NO2
Molecular Weight:
177.0808
IUPAC Name:
2,5,6-trifluoropyridine-3-carboxylic acid
InChI:
InChI=1S/C6H2F3NO2/c7-3-1-2(6(11)12)4(8)10-5(3)9/h1H,(H,11,12)
InChI Key:
PSLBDVQUNRNSSA-UHFFFAOYSA-N
SMILES:
Fc1cc(C(=O)O)c(nc1F)F

Properties

Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.082g/mol
Monoisotopic Mass:
177.004g/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  

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