Compound 282
  CheckMol                        TMF02:r0:m0
MF=C10H20O2 MW=172.27
 12 11  0  0  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0117   -1.4802   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2687   -2.2202   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3157   -2.2202   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6196   -1.4567   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9236   -2.1967   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2275   -1.4332   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5315   -2.1732   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8354   -1.4097   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1393   -2.1497   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4433   -1.3862   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7472   -2.1262   -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
  4  5  1  0  0  0  0
  5  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
M  END

2D Structure

Capric Acid

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Chemical Name - Capric Acid
Mol Weight - 172.267
Smiles - CCCCCCCCCC(O)=O

Property Name	Property Value
Mol Name	Capric Acid
Molweight	172.267
Monoisotopic Mass	172.14633
Clogp	3.3361
Clogs	-2.619
H Acceptors	2
H Donors	1
Total Surface Area	159.94
Relative Psa	0.16344
Polar Surface Area	37.3
Druglikeness	-25.216
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Shape Index	0.91667
Molecular Flexibility	0.5527
Molecular Complexity	0.41589
Fragments	1
Non H Atoms	12
Non Ch Atoms	2
Electronegative Atoms	2
Rotatable Bonds	8
Sp3 Atoms	10
Acidic Oxygens	1
Smiles	CCCCCCCCCC(O)=O
InChIKey	InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
InChI	GHVNFZFCNZKVNT-UHFFFAOYSA-N

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1 — Capric Acid | 2 — Capric Acid