Chem 1133 Tetraethoxypropane AlkaliMetal

Compound 275
  CheckMol                        TMF02:r0:m0
MF=C11H24O4 MW=220.31
 15 14  0  0  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3063    0.7532   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2828    0.7532   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3181    2.2596   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6126    0.0118   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5656    0.0118   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0353    3.0128   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9190    0.7650   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0471    4.5192   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9307    2.2714   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2253    0.0235   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6480    3.0246   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5316    0.7767   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6597    4.5309   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8379    0.0353   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  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
  8 10  1  0  0  0  0
  8 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
M  END

1,1,3,3-Tetraethoxypropane

₹ 0.00 0.00

Chemical Name - 1,1,3,3-Tetraethoxypropane
Mol Weight - 220.308
Smiles - CCOC(CC(OCC)OCC)OCC

Property Name	Property Value
Mol Name	1,1,3,3-Tetraethoxypropane
Molweight	220.308
Monoisotopic Mass	220.16746
Clogp	1.4996
Clogs	-1.58
H Acceptors	4
Total Surface Area	196.34
Relative Psa	0.20373
Polar Surface Area	36.92
Druglikeness	-15.433
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Shape Index	0.6
Molecular Flexibility	0.67556
Molecular Complexity	0.38686
Fragments	1
Non H Atoms	15
Non Ch Atoms	4
Electronegative Atoms	4
Rotatable Bonds	10
Sp3 Atoms	15
Symmetric Atoms	10
Smiles	CCOC(CC(OCC)OCC)OCC
InChIKey	InChI=1S/C11H24O4/c1-5-12-10(13-6-2)9-11(14-7-3)15-8-4/h10-11H,5-9H2,1-4H3
InChI	KVJHGPAAOUGYJX-UHFFFAOYSA-N

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1 - 1,1,3,3-Tetraethoxypropane
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1,1,3,3-Tetraethoxypropane