Chem 26 Dichloro 3 Nitro Pyridine Dsrpl

Compound 136
  CheckMol                        TMF02:r0:m0
MF=C5H2Cl2N2O2 MW=192.99
 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
    1.2868    0.7555   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5736    0.0118   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
    1.2750    2.2666   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    3.8603    0.7673   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0354    3.0222   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5618    3.0340   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    5.1471    0.0236   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.8485    2.2784   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0472    4.5332   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3458    2.2784   -0.0000 O   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
  6 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7  9 01  0  1  0  0
M  CHG  1   6   1
M  CHG  1  11  -1
M  END

2,6-Dichloro-3-Nitro Pyridine

₹ 0.00 0.00

Chemical Name - 2,6-Dichloro-3-Nitro Pyridine
Mol Weight - 192.989
Smiles - [O-][N+](c(c(Cl)n1)ccc1Cl)=O

Property Name	Property Value
Mol Name	2,6-Dichloro-3-Nitro Pyridine
Molweight	192.989
Monoisotopic Mass	191.949332
Clogp	1.1439
Clogs	-2.279
H Acceptors	4
Total Surface Area	126.53
Relative Psa	0.32712
Polar Surface Area	58.71
Druglikeness	-7.0838
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.63636
Molecular Flexibility	0.35822
Molecular Complexity	0.74753
Fragments	1
Non H Atoms	11
Non Ch Atoms	6
Electronegative Atoms	6
Rotatable Bonds	1
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	1
Aromatic Nitrogens	1
Acidic Oxygens	1
Smiles	[O-][N+](c(c(Cl)n1)ccc1Cl)=O
InChIKey	InChI=1S/C5H2Cl2N2O2/c6-4-2-1-3(9(10)11)5(7)8-4/h1-2H
InChI	SHCWQWRTKPNTEM-UHFFFAOYSA-N

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2,6-Dichloro-3-Nitro Pyridine