Chem 23456 Pentachloro Pyridine Dsrpl

Compound 143
  CheckMol                        TMF02:r0:m0
MF=C5Cl5N MW=251.33
 11 11  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2967   -0.7495   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5935    0.0119   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
    1.2848   -2.2485   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8902   -0.7376   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0357   -2.9861   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.5816   -2.9861   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1870    0.0238   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.8783   -2.2366   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5697   -4.4851   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    5.1751   -2.9861   -0.0000 Cl  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  1  0  0  0  0
  4  7 02  0  1  0  0
  5  8  1  0  0  0  0
  5  9 02  0  1  0  0
  7 10  1  0  0  0  0
  9 11  1  0  0  0  0
  7  9 01  0  1  0  0
M  END

2,3,4,5,6-Pentachloro Pyridine

₹ 0.00 0.00

Chemical Name - 2,3,4,5,6-Pentachloro Pyridine
Mol Weight - 251.327
Smiles - Clc(c(Cl)c(nc1Cl)Cl)c1Cl

Property Name	Property Value
Mol Name	2,3,4,5,6-Pentachloro Pyridine
Molweight	251.327
Monoisotopic Mass	248.847334
Clogp	3.8835
Clogs	-4.027
H Acceptors	1
Total Surface Area	149.12
Relative Psa	0.073565
Polar Surface Area	12.89
Druglikeness	-1.689
Mutagenic	high
Tumorigenic	none
Reproductive Effective	low
Irritant	low
Shape Index	0.54545
Molecular Complexity	0.80147
Fragments	1
Non H Atoms	11
Non Ch Atoms	6
Electronegative Atoms	6
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Symmetric Atoms	4
Aromatic Nitrogens	1
Smiles	Clc(c(Cl)c(nc1Cl)Cl)c1Cl
InChIKey	InChI=1S/C5Cl5N/c6-1-2(7)4(9)11-5(10)3(1)8
InChI	DNDPLEAVNVOOQZ-UHFFFAOYSA-N

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1 - 2,3,4,5,6-Pentachloro Pyridine
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2,3,4,5,6-Pentachloro Pyridine