Mol Weight - 179.99
Smiles - CN(C(C(Cl)=C1Cl)=O)C1=O
| Property Name | Property Value |
| Mol Name | N-methyl-3,4-dichloromaleimide |
| Molweight | 179.99 |
| Monoisotopic Mass | 178.954083 |
| Clogp | 0.0862 |
| Clogs | -1.611 |
| H Acceptors | 3 |
| Total Surface Area | 111.82 |
| Relative Psa | 0.26498 |
| Polar Surface Area | 37.38 |
| Druglikeness | 1.5208 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | low |
| Nasty Functions | 1 |
| Shape Index | 0.5 |
| Molecular Complexity | 0.79025 |
| Fragments | 1 |
| Non H Atoms | 10 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 1 |
| Symmetric Atoms | 4 |
| Amides | 1 |
| Smiles | CN(C(C(Cl)=C1Cl)=O)C1=O |
| InChIKey | InChI=1S/C5H3Cl2NO2/c1-8-4(9)2(6)3(7)5(8)10/h1H3 |
| InChI | PYOLPWAVSYVLMM-UHFFFAOYSA-N |
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1 — N-methyl-3,4-dichloromaleimide | 2 — N-methyl-3,4-dichloromaleimide