Chem 2 Fluoro Trifluoromethylpyridine Dsrpl

Compound 142
  CheckMol                        TMF02:r0:m0
MF=C6H3F4N MW=165.10
 11 11  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3110   -0.7323   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6220    0.0354   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3228   -2.2204   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9330   -0.6968   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6338   -2.9527   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0354   -2.9645   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9448   -2.1850   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    0.7086   -1.6535   -0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.2519   -3.7086   -0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8031   -4.2519   -0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3 02  0  1  0  0
  2  4 01  0  1  0  0
  3  5 01  0  1  0  0
  4  6 02  0  1  0  0
  4  7  1  0  0  0  0
  5  8 02  0  1  0  0
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  6  8 01  0  1  0  0
M  END

2-fluoro-trifluoromethylpyridine

₹ 0.00 0.00

Chemical Name - 2-fluoro-trifluoromethylpyridine
Mol Weight - 165.089
Smiles - FC(c1cccnc1F)(F)F

Property Name	Property Value
Mol Name	2-fluoro-trifluoromethylpyridine
Molweight	165.089
Monoisotopic Mass	165.020161
Clogp	1.9592
Clogs	-2.438
H Acceptors	1
Total Surface Area	107.83
Relative Psa	0.10173
Polar Surface Area	12.89
Druglikeness	-8.9598
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.54545
Molecular Flexibility	0.47198
Molecular Complexity	0.6868
Fragments	1
Non H Atoms	11
Non Ch Atoms	5
Electronegative Atoms	5
Rotatable Bonds	1
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	1
Symmetric Atoms	2
Aromatic Nitrogens	1
Smiles	FC(c1cccnc1F)(F)F
InChIKey	InChI=1S/C6H3F4N/c7-5-4(6(8,9)10)2-1-3-11-5/h1-3H
InChI	UTAQOVYPSZIDTK-UHFFFAOYSA-N

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1 - 2-fluoro-trifluoromethylpyridine
2 - 2-fluoro-trifluoromethylpyridine

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2-fluoro-trifluoromethylpyridine