2-(1,3-Benzodioxol-5-ylmethylidene)-4,4-dimethyl-3-oxopentanenitrile
2-(1,3-benzodioxol-5-ylmethylidene)-4,4-dimethyl-3-oxopentanenitrile
Also Known As: MS-6425|KS-000028M5|2-[(2H-1,3-benzodioxol-5-yl)methylidene]-4,4-dimethyl-3-oxopentanenitrile|2-(1,3-benzodioxol-5-ylmethylidene)-4,4-dimethyl-3-oxopentanenitrile|(E)-3-(1,3-benzodioxol-5-yl)-2-(2,2-dimethylpropanoyl)-2-propenenitrile|3-BENZO[3,4-D]1,3-DIOXOLEN-5-YL-2-(2,2-DIMETHYLPROPANOYL)PROP-2-ENENITRILE|2-(1,3-benzodioxol-5-ylmethylene)-4,4-dimethyl-3-oxo-pentanenitrile|2-(benzo[1,3]dioxol-5-ylmethylidene)-4,4-dimethyl-3-oxo-pentanenitrile
| Molecular Formula | C15H15NO3 |
|---|---|
| Molecular Weight | 257.1052 g/mol |
| LogP | 2.93748 |
| Topological Polar Surface Area | 59.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.1052 |
| Monoisotopic Mass | 257.1052 |
| Heavy Atoms | 19 |
| Complexity | 588.38873 |
Chemical Identifiers
| CAS Number | 391649-79-9 |
|---|---|
| SMILES | CC(C)(C)C(=O)C(=CC1=CC2=C(C=C1)OCO2)C#N |
Product Overview
2-(1,3-Benzodioxol-5-ylmethylidene)-4,4-dimethyl-3-oxopentanenitrile (CAS 391649-79-9), with molecular formula C15H15NO3 and molecular weight 257.1052 g/mol. IUPAC: 2-(1,3-benzodioxol-5-ylmethylidene)-4,4-dimethyl-3-oxopentanenitrile.
2-(1,3-Benzodioxol-5-ylmethylidene)-4,4-dimethyl-3-oxopentanenitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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