2-Isocyano-1-(4-methylpiperazin-1-yl)ethanone
2-isocyano-1-(4-methylpiperazin-1-yl)ethanone
Also Known As: 2-isocyano-1-(4-methylpiperazin-1-yl)ethanone|N-Methylpiperazino-isocyano-acetamide|2-isocyano-1-(4-methylpiperazin-1-yl)ethan-1-one|2-isocyano-1-(4-methyl-1-piperazinyl)Ethanone|2-Isocyano-1-(4-methyl-piperazin-1-yl)-ethanone|2-isocyano-l-(4-methyl-piperazin-1-yl)-ethanone
| Molecular Formula | C8H13N3O |
|---|---|
| Molecular Weight | 167.10587 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 27.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 167.10587 |
| Monoisotopic Mass | 167.10587 |
| Heavy Atoms | 12 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 67685-95-4 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)C[N+]#[C-] |
| InChIKey | MILFKCBKYQQRHW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Isocyano-1-(4-methylpiperazin-1-yl)ethanone (CAS 67685-95-4), with molecular formula C8H13N3O and molecular weight 167.10587 g/mol. IUPAC: 2-isocyano-1-(4-methylpiperazin-1-yl)ethanone.
2-Isocyano-1-(4-methylpiperazin-1-yl)ethanone is a custom synthesis product. We offer services from milligram to kilogram scale.
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