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Di Ethyl Ketone


  • SKU Code: CH136796
Chemical Name - Di Ethyl Ketone
Mol Weight - 86.1334
Smiles - CCC(CC)=O
Property Name Property Value
Mol NameDi Ethyl Ketone
Molweight86.1334
Monoisotopic Mass86.073165
Clogp1.2874
Clogs-1.446
H Acceptors1
Total Surface Area83.29
Relative Psa0.15656
Polar Surface Area17.07
Druglikeness-0.42787
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritanthigh
Shape Index0.83333
Molecular Flexibility0.71472
Molecular Complexity0.69315
Fragments1
Non H Atoms6
Non Ch Atoms1
Electronegative Atoms1
Rotatable Bonds2
Sp3 Atoms4
Symmetric Atoms2
SmilesCCC(CC)=O
InChIC5H10O

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