Chem 2 Amino 4 Chloro 6 Nitro Phenol

Compound 20
  CheckMol                        TMF02:r0:m0
MF=C6H5ClN2O3 MW=188.57
 12 12  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.0117    1.5037   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3157    2.2673   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2687    2.2673   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3275    3.7709   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    1.2570    3.7709   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6314    4.5228   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0470    4.5228   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
    2.5374    4.5228   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6432    6.0264   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9354    3.7827   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0587    6.0264   -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 02  0  1  0  0
  5  7  1  0  0  0  0
  5  8 02  0  1  0  0
  6  9  1  0  0  0  0
  7 10  2  0  0  0  0
  7 11  1  0  0  0  0
  8 12  1  0  0  0  0
  6  8 01  0  1  0  0
M  CHG  1   7   1
M  CHG  1  11  -1
M  END

2-Amino 4-Chloro 6-Nitro Phenol

₹ 0.00 0.00

Chemical Name - 2-Amino 4-Chloro 6-Nitro Phenol
Mol Weight - 188.57
Smiles - Nc1cc(Cl)cc([N+]([O-])=O)c1O

Property Name	Property Value
Mol Name	2-Amino 4-Chloro 6-Nitro Phenol
Molweight	188.57
Monoisotopic Mass	187.99887
Clogp	0.321
Clogs	-2.592
H Acceptors	5
H Donors	2
Total Surface Area	127.22
Relative Psa	0.46211
Polar Surface Area	92.07
Druglikeness	-6.9261
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.5
Molecular Flexibility	0.33783
Molecular Complexity	0.70325
Fragments	1
Non H Atoms	12
Non Ch Atoms	6
Electronegative Atoms	6
Rotatable Bonds	1
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	2
Amines	1
Aromatic Amines	1
Acidic Oxygens	1
Smiles	Nc1cc(Cl)cc([N+]([O-])=O)c1O
InChIKey	InChI=1S/C6H5ClN2O3/c7-3-1-4(8)6(10)5(2-3)9(11)12/h1-2,10H,8H2
InChI	MHAFRUMLQZZSIN-UHFFFAOYSA-N

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2-Amino 4-Chloro 6-Nitro Phenol