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Compound 20
  CheckMol                        TMF02:r0:m0
MF=C26H52O2 MW=396.70
 28 27  0  0  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118   -1.4890   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3236   -2.2336   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2763   -2.2336   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6354   -1.4654   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5645   -1.4654   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9471   -2.2099   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8526   -2.2099   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2589   -1.4418   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1407   -1.4418   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5707   -2.1863   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4289   -2.1863   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8825   -1.4181   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7170   -1.4181   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1942   -2.1627   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0052   -2.1627   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5060   -1.3945   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2933   -1.3945   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8178   -2.1390   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5814   -2.1390   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8696   -1.3709   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1577   -2.1154   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4459   -1.3472   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7340   -2.0917   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0221   -1.3236   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3103   -2.0681   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5984   -1.3000   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8865   -2.0445   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
M  END

Octyl Stearate

₹ 0.00 0.00

Chemical Name - Octyl Stearate
Mol Weight - 396.697
Smiles - CCCCCCCCCCCCCCCCCC(OCCCCCCCC)=O

Property Name	Property Value
Mol Name	Octyl Stearate
Molweight	396.697
Monoisotopic Mass	396.39673
Clogp	10.532
Clogs	-6.827
H Acceptors	2
Total Surface Area	382.25
Relative Psa	0.060275
Polar Surface Area	26.3
Druglikeness	-30.202
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.96429
Molecular Flexibility	0.54725
Molecular Complexity	0.47083
Non H Atoms	28
Non Ch Atoms	2
Electronegative Atoms	2
Rotatable Bonds	24
Sp3 Atoms	26
Smiles	CCCCCCCCCCCCCCCCCC(OCCCCCCCC)=O

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Octyl Stearate