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Chem 14 Dioxane 1,4 Dioxane 179 | Buy Chemicals | Chemryt

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1,4 Dioxane


  • SKU Code: CH137106
Chemical Name - 1,4 Dioxane
Mol Weight - 88.1055
Smiles - C1OCCOC1
Property Name Property Value
Mol Name1,4 Dioxane
Molweight88.1055
Monoisotopic Mass88.05243
Clogp-0.276
Clogs-0.372
H Acceptors2
Total Surface Area75.04
Relative Psa0.26652
Polar Surface Area18.46
Druglikeness-13.655
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Shape Index0.66667
Molecular Flexibility0.26035
Molecular Complexity0.53648
Fragments1
Non H Atoms6
Non Ch Atoms2
Electronegative Atoms2
Rings Closures1
Small Rings1
Sp3 Atoms6
Symmetric Atoms4
SmilesC1OCCOC1
InChIKeyInChI=1S/C4H8O2/c1-2-6-4-3-5-1/h1-4H2
InChIRYHBNJHYFVUHQT-UHFFFAOYSA-N

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