Chem Arachidic Acid Methyl Ester

Compound 15
  CheckMol                        TMF02:r0:m0
MF=C21H42O2 MW=326.56
 23 22  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   -1.4837   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2718   -2.2138   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3189   -2.2138   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5553   -1.4602   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6260   -1.4602   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9331   -2.1903   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2402   -1.4366   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5473   -2.1667   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8544   -1.4131   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1615   -2.1432   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4686   -1.3895   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7757   -2.1196   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0828   -1.3660   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3899   -2.0961   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.6970   -1.3424   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0041   -2.0725   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.3112   -1.3189   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.6183   -2.0490   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.9254   -1.2953   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -22.2325   -2.0254   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -23.5396   -1.2718   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -24.8467   -2.0019   -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  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  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
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
M  END

Arachidic Acid Methyl Ester

₹ 0.00 0.00

Chemical Name - Arachidic Acid Methyl Ester
Mol Weight - 326.562
Smiles - CCCCCCCCCCCCCCCCCCCC(OC)=O

Property Name	Property Value
Mol Name	Arachidic Acid Methyl Ester
Molweight	326.562
Monoisotopic Mass	326.31848
Clogp	8.308
Clogs	-5.447
H Acceptors	2
Total Surface Area	313.45
Relative Psa	0.073505
Polar Surface Area	26.3
Druglikeness	-35.364
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.95652
Molecular Flexibility	0.51637
Molecular Complexity	0.41291
Fragments	1
Non H Atoms	23
Non Ch Atoms	2
Electronegative Atoms	2
Rotatable Bonds	19
Sp3 Atoms	21
Smiles	CCCCCCCCCCCCCCCCCCCC(OC)=O
InChIKey
InChI	C21H42O2

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Arachidic Acid Methyl Ester