Chem Acetic Acid 2 Rekhc | Cheminformatics
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2D Structure

Acetic Acid


  • SKU Code: CH140304
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Chemical Name - Acetic Acid
Mol Weight - 60.0518
Smiles - CC(O)=O
Property Name Property Value
Mol NameAcetic Acid
Molweight60.0518
Monoisotopic Mass60.02113
Clogp-0.2991
Clogs-0.459
H Acceptors2
H Donors1
Total Surface Area49.86
Relative Psa0.52427
Polar Surface Area37.3
Druglikeness-2.2628
Mutagenichigh
Tumorigenicnone
Reproductive Effectivehigh
Irritanthigh
Shape Index0.75
Fragments1
Non H Atoms4
Non Ch Atoms2
Electronegative Atoms2
Sp3 Atoms2
Acidic Oxygens1
SmilesCC(O)=O
InChIKeyInChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
InChIQTBSBXVTEAMEQO-UHFFFAOYSA-N

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