Chem 2 Ethyl Hexanol | Cheminformatics
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2D Structure

2-Ethyl Hexanol


  • SKU Code: CH138802
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Chemical Name - 2-Ethyl Hexanol
Mol Weight - 130.23
Smiles - CCCCC(CC)CO
Property Name Property Value
Mol Name2-Ethyl Hexanol
Molweight130.23
Monoisotopic Mass130.135765
Clogp2.5408
Clogs-1.987
H Acceptors1
H Donors1
Total Surface Area125.67
Relative Psa0.10424
Polar Surface Area20.23
Druglikeness-9.5069
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritanthigh
Shape Index0.77778
Molecular Flexibility0.71636
Molecular Complexity0.48648
Fragments1
Non H Atoms9
Non Ch Atoms1
Electronegative Atoms1
Stereo Centers1
Rotatable Bonds5
Sp3 Atoms9
SmilesCCCCC(CC)CO
InChIKeyInChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3
InChIYIWUKEYIRIRTPP-UHFFFAOYSA-N

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