carboquone
[2-[2,5-bis(aziridin-1-yl)-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl]-2-methoxyethyl] carbamate
| Molecular Formula | C15H19N3O5 |
|---|---|
| Molecular Weight | 321.33 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 102.0 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 321.13248 |
| Heavy Atoms | 23 |
| Complexity | 643.0 |
Chemical Identifiers
| CAS Number | 24279-91-2 |
|---|---|
| SMILES | CC1=C(C(=O)C(=C(C1=O)N2CC2)C(COC(=O)N)OC)N3CC3 |
| InChIKey | SHHKQEUPHAENFK-UHFFFAOYSA-N |
📖 Product Overview
carboquone (CAS: 24279-91-2) is a chemical compound with molecular formula C15H19N3O5 and molecular weight 321.33 g/mol. Its IUPAC systematic name is [2-[2,5-bis(aziridin-1-yl)-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl]-2-methoxyethyl] carbamate.
SHHKQEUPHAENFK-UHFFFAOYSA-N.
SMILES: CC1=C(C(=O)C(=C(C1=O)N2CC2)C(COC(=O)N)OC)N3CC3.
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