Chem Glycerine 2 Suprav | Cheminformatics
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2D Structure

Glycerine


  • SKU Code: CH140180
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Chemical Name - Glycerine
Mol Weight - 92.0935
Smiles - OCC(CO)O
Property Name Property Value
Mol NameGlycerine
Molweight92.0935
Monoisotopic Mass92.047345
Clogp-1.4436
Clogs0.159
H Acceptors3
H Donors3
Total Surface Area72.57
Relative Psa0.54155
Polar Surface Area60.69
Druglikeness-3.0756
Mutagenichigh
Tumorigenicnone
Reproductive Effectivehigh
Irritanthigh
Shape Index0.83333
Molecular Flexibility0.80023
Molecular Complexity0.69315
Fragments1
Non H Atoms6
Non Ch Atoms3
Electronegative Atoms3
Rotatable Bonds2
Sp3 Atoms6
Symmetric Atoms2
SmilesOCC(CO)O
InChIKeyInChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2
InChIPEDCQBHIVMGVHV-UHFFFAOYSA-N

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