Chem N Chlorophthalimide | Cheminformatics
2D Structure

N-Chlorophthalimide


  • SKU Code: CH137982
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Chemical Name - N-Chlorophthalimide
Mol Weight - 181.578
Smiles - O=C(c(cccc1)c1C1=O)N1Cl
Property Name Property Value
Mol NameN-Chlorophthalimide
Molweight181.578
Monoisotopic Mass180.993056
Clogp-0.4788
Clogs-2.104
H Acceptors3
Total Surface Area120.98
Relative Psa0.24492
Polar Surface Area37.38
Druglikeness0.69508
Mutageniclow
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.5
Molecular Complexity0.72397
Fragments1
Non H Atoms12
Non Ch Atoms4
Electronegative Atoms4
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms6
Symmetric Atoms5
SmilesO=C(c(cccc1)c1C1=O)N1Cl
InChIKeyInChI=1S/C8H4ClNO2/c9-10-7(11)5-3-1-2-4-6(5)8(10)12/h1-4H
InChIWDRFYIPWHMGQPN-UHFFFAOYSA-N

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