Chem Trichlorobenzene | Cheminformatics
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2D Structure

Trichlorobenzene


  • SKU Code: CH138806
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Chemical Name - Trichlorobenzene
Mol Weight - 181.449
Smiles - Clc1cccc(Cl)c1Cl
Property Name Property Value
Mol NameTrichlorobenzene
Molweight181.449
Monoisotopic Mass179.930031
Clogp3.4776
Clogs-3.824
Total Surface Area119.52
Druglikeness-2.0851
Mutagenichigh
Tumorigeniclow
Reproductive Effectivelow
Irritanthigh
Shape Index0.55556
Molecular Complexity0.65976
Fragments1
Non H Atoms9
Non Ch Atoms3
Electronegative Atoms3
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Symmetric Atoms3
SmilesClc1cccc(Cl)c1Cl
InChIKeyInChI=1S/C6H3Cl3/c7-4-2-1-3-5(8)6(4)9/h1-3H
InChIRELMFMZEBKVZJC-UHFFFAOYSA-N

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