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2D Structure

Salicylaldehyde


  • SKU Code: CH137534
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Chemical Name - Salicylaldehyde
Mol Weight - 122.123
Smiles - Oc1c(C=O)cccc1
Property Name Property Value
Mol NameSalicylaldehyde
Molweight122.123
Monoisotopic Mass122.03678
Clogp1.2472
Clogs-1.644
H Acceptors2
H Donors1
Total Surface Area99.15
Relative Psa0.26364
Polar Surface Area37.3
Druglikeness-4.1407
Mutagenichigh
Tumorigenicnone
Reproductive Effectivehigh
Irritanthigh
Shape Index0.66667
Molecular Flexibility0.33178
Molecular Complexity0.69315
Fragments1
Non H Atoms9
Non Ch Atoms2
Electronegative Atoms2
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms1
SmilesOc1c(C=O)cccc1
InChIKeyInChI=1S/C7H6O2/c8-5-6-3-1-2-4-7(6)9/h1-5,9H
InChISMQUZDBALVYZAC-UHFFFAOYSA-N

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