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2D Structure

Pyranol


  • SKU Code: CH140050
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Chemical Name - Pyranol
Mol Weight - 98.1006
Smiles - OC1OC=CC=C1
Property Name Property Value
Mol NamePyranol
Molweight98.1006
Monoisotopic Mass98.03678
Clogp-0.0054
Clogs-1.071
H Acceptors2
H Donors1
Total Surface Area81.85
Relative Psa0.28222
Polar Surface Area29.46
Druglikeness-1.2483
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.71429
Molecular Flexibility0.22518
Molecular Complexity0.73241
Fragments1
Non H Atoms7
Non Ch Atoms2
Electronegative Atoms2
Stereo Centers1
Rings Closures1
Small Rings1
Sp3 Atoms3
SmilesOC1OC=CC=C1
InChIKeyInChI=1S/C5H6O2/c6-5-3-1-2-4-7-5/h1-6H
InChIGSSXLFACIJSBOM-UHFFFAOYSA-N

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