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2D Structure

Acetaldehyde


  • SKU Code: CH137030
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Chemical Name - Acetaldehyde
Mol Weight - 44.0528
Smiles - CC=O
Property Name Property Value
Mol NameAcetaldehyde
Molweight44.0528
Monoisotopic Mass44.026215
Clogp-0.1618
Clogs-0.692
H Acceptors1
Total Surface Area45.3
Relative Psa0.28786
Polar Surface Area17.07
Druglikeness-2.27
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Shape Index1
Fragments1
Non H Atoms3
Non Ch Atoms1
Electronegative Atoms1
Sp3 Atoms1
SmilesCC=O
InChIKeyInChI=1S/C2H4O/c1-2-3/h2H,1H3
InChIIKHGUXGNUITLKF-UHFFFAOYSA-N

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