Chem Tri Propylene Glycol Pacific

Compound 123
  CheckMol                        TMF02:r0:m0
MF=C9H20O4 MW=192.25
 13 12  0  0  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3142   -0.7459   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2905   -0.7459   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6284    0.0118   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3261   -2.2377   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5811    0.0118   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9427   -0.7341   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8716   -0.7341   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5692    1.5273   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1622    0.0237   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4527   -0.7222   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4409   -2.2140   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7432    0.0355   -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
  6  8  1  0  0  0  0
  6  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
M  END

Tri Propylene Glycol

₹ 0.00 0.00

Chemical Name - Tri Propylene Glycol
Mol Weight - 192.254
Smiles - CC(COC(C)COC(C)CO)O

Property Name	Property Value
Mol Name	Tri Propylene Glycol
Molweight	192.254
Monoisotopic Mass	192.13616
Clogp	0.0167
Clogs	-0.946
H Acceptors	4
H Donors	2
Total Surface Area	161.76
Relative Psa	0.28561
Polar Surface Area	58.92
Druglikeness	-7.7015
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	low
Shape Index	0.76923
Molecular Flexibility	0.65853
Molecular Complexity	0.45134
Fragments	1
Non H Atoms	13
Non Ch Atoms	4
Electronegative Atoms	4
Stereo Centers	3
Rotatable Bonds	7
Sp3 Atoms	13
Smiles	CC(COC(C)COC(C)CO)O
InChIKey	InChI=1S/C9H20O4/c1-7(11)5-12-9(3)6-13-8(2)4-10/h7-11H,4-6H2,1-3H3
InChI	LCZVSXRMYJUNFX-UHFFFAOYSA-N

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Tri Propylene Glycol