1,3-Di-tert-butyl-2,5-dioxocyclopent-3-ene-1-carbonitrile
1,3-ditert-butyl-2,5-dioxocyclopent-3-ene-1-carbonitrile
Also Known As: 1,3-ditert-butyl-2,5-dioxocyclopent-3-ene-1-carbonitrile|1,3-Di-tert-butyl-2,5-dioxocyclopent-3-ene-1-carbonitrile
CAS: 41299-14-3
| Molecular Formula | C14H19NO2 |
|---|---|
| Molecular Weight | 233.14159 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.14159 |
| Monoisotopic Mass | 233.14159 |
| Heavy Atoms | 17 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 41299-14-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=O)C(C1=O)(C#N)C(C)(C)C |
| InChIKey | YVGKZQRYZABJGL-UHFFFAOYSA-N |
Product Overview
1,3-Di-tert-butyl-2,5-dioxocyclopent-3-ene-1-carbonitrile (CAS 41299-14-3), with molecular formula C14H19NO2 and molecular weight 233.14159 g/mol. IUPAC: 1,3-ditert-butyl-2,5-dioxocyclopent-3-ene-1-carbonitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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1,3-Di-tert-butyl-2,5-dioxocyclopent-3-ene-1-carbonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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