Chem 4 Chloro 3 5 Dimethylphenol

Compound 27
  CheckMol                        TMF02:r0:m0
MF=C8H9ClO MW=156.61
 10 10  0  1  0               999 V2000
    0.0000   -0.0000   -0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.3082   -0.7425   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3200   -2.2275   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6164    0.0236   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6282   -2.9582   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0354   -2.9700   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9246   -0.7071   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6282    1.5321   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9364   -2.2039   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2446   -2.9346   -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
  3  6  1  0  0  0  0
  4  7 02  0  1  0  0
  4  8  1  0  0  0  0
  5  9 02  0  1  0  0
  9 10  1  0  0  0  0
  7  9 01  0  1  0  0
M  END

(4-Chloro-3, 5-dimethylphenol)

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Chemical Name - (4-Chloro-3, 5-dimethylphenol)
Mol Weight - 156.611
Smiles - Cc1cc(O)cc(C)c1Cl

Property Name	Property Value
Mol Name	(4-Chloro-3, 5-dimethylphenol)
Molweight	156.611
Monoisotopic Mass	156.034192
Clogp	2.6077
Clogs	-2.744
H Acceptors	1
H Donors	1
Total Surface Area	119.55
Relative Psa	0.10958
Polar Surface Area	20.23
Druglikeness	-2.0981
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	high
Shape Index	0.6
Molecular Complexity	0.65917
Fragments	1
Non H Atoms	10
Non Ch Atoms	2
Electronegative Atoms	2
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3 Atoms	3
Symmetric Atoms	3
Smiles	Cc1cc(O)cc(C)c1Cl
InChIKey	InChI=1S/C8H9ClO/c1-5-3-7(10)4-6(2)8(5)9/h3-4,10H,1-2H3
InChI	OSDLLIBGSJNGJE-UHFFFAOYSA-N

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(4-Chloro-3, 5-dimethylphenol)