Chem Linoleic Acid Methyl Ester

Compound 28
  CheckMol                        TMF02:r0:m0
MF=C19H34O2 MW=294.48
 21 20  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   -1.4918   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2787   -2.2258   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3260   -2.2258   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5692   -1.4681   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6402   -1.4681   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9544   -2.2022   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2686   -1.4444   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5828   -2.1785   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8970   -1.4207   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2112   -2.1548   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5254   -1.3971   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8396   -2.1311   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8514   -3.6229   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1656   -4.3688   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1775   -5.8606   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8869   -6.5946   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8988   -8.0864   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6083   -8.8205   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6201  -10.3123   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3296  -11.0463   -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
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  END

Linoleic Acid Methyl Ester

₹ 0.00 0.00

Chemical Name - Linoleic Acid Methyl Ester
Mol Weight - 294.477
Smiles - CCCCC/C=CC/C=CCCCCCCCC(OC)=O

Property Name	Property Value
Mol Name	Linoleic Acid Methyl Ester
Molweight	294.477
Monoisotopic Mass	294.25588
Clogp	6.8948
Clogs	-4.451
H Acceptors	2
Total Surface Area	283.89
Relative Psa	0.081158
Polar Surface Area	26.3
Druglikeness	-35.728
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.95238
Molecular Flexibility	0.66693
Molecular Complexity	0.39608
Fragments	1
Non H Atoms	21
Non Ch Atoms	2
Electronegative Atoms	2
Rotatable Bonds	15
Sp3 Atoms	15
Smiles	CCCCC/C=CC/C=CCCCCCCCC(OC)=O
InChIKey
InChI	C19H34O2

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Linoleic Acid Methyl Ester