Compound 18
  CheckMol                        TMF02:r0:m0
MF=C6H10O4 MW=146.14
 10  9  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    1.5076   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2720    2.2613   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3191    2.2613   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5558    1.5193   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3309    3.7689   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6264    1.5193   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8396    2.2731   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9338    2.2731   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2411    1.5311   -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  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
M  END

2D Structure

Diethyl Oxalate

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Chemical Name - Diethyl Oxalate
Mol Weight - 146.141
Smiles - CCOC(C(OCC)=O)=O

Property Name	Property Value
Mol Name	Diethyl Oxalate
Molweight	146.141
Monoisotopic Mass	146.05791
Clogp	0.093
Clogs	-0.79
H Acceptors	4
Total Surface Area	121.04
Relative Psa	0.3807
Polar Surface Area	52.6
Druglikeness	-15.174
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Shape Index	0.8
Molecular Flexibility	0.32403
Molecular Complexity	0.64124
Fragments	1
Non H Atoms	10
Non Ch Atoms	4
Electronegative Atoms	4
Rotatable Bonds	5
Sp3 Atoms	6
Symmetric Atoms	5
Smiles	CCOC(C(OCC)=O)=O
InChIKey	InChI=1S/C6H10O4/c1-3-9-5(7)6(8)10-4-2/h3-4H2,1-2H3
InChI	WYACBZDAHNBPPB-UHFFFAOYSA-N

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1 — Diethyl Oxalate | 2 — Diethyl Oxalate