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Chem Dicyandiamide | Cheminformatics

dicyandiamide


  • SKU Code: CH137843
Chemical Name - dicyandiamide
Mol Weight - 84.0818
Smiles - NC(N)=NC#N
Property Name Property Value
Mol Namedicyandiamide
Molweight84.0818
Monoisotopic Mass84.043596
Clogp-1.5296
Clogs-1.188
H Acceptors4
H Donors2
Total Surface Area75.22
Relative Psa0.7393
Polar Surface Area88.19
Druglikeness-3.4058
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.83333
Molecular Complexity0.80472
Fragments1
Non H Atoms6
Non Ch Atoms4
Electronegative Atoms4
Symmetric Atoms1
Basic Nitrogens1
SmilesNC(N)=NC#N
InChIKeyInChI=1S/C2H4N4/c3-1-6-2(4)5/h(H4,4,5,6)
InChIQGBSISYHAICWAH-UHFFFAOYSA-N

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