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2D Structure

Octane


  • SKU Code: CH136273
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Chemical Name - Octane
Mol Weight - 114.231
Smiles -
Property Name Property Value
Mol Name Octane
Molweight114.231
Monoisotopic Mass114.14085
Clogp3.7036
Clogs-2.604
Total Surface Area120.58
Druglikeness-17.528
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index1
Molecular Flexibility0.48023
Molecular Complexity0.3662
Non H Atoms8
Rotatable Bonds5
Sp3 Atoms8
Symmetric Atoms4
Smiles

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