2-Cyano-1,1,1-trifluoropropan-2-yl acetate
(2-cyano-1,1,1-trifluoropropan-2-yl) acetate
Also Known As: 2-Methyl-oct-1-en|AC1L1QSO|RefChem:1062879|3,3,3-Trifluoro-2-methyllactonitrile acetate|2-cyano-1,1,1-trifluoropropan-2-yl acetate|(2-cyano-1,1,1-trifluoropropan-2-yl) acetate|BRN 2085954|CTK8I7844|BRN 1779852|SYJSGYHJKLGFQT-UHFFFAOYSA-N|2-Methyl-3,3,3-trifluorolactonitrile acetate|Acetic acid 1-cyano-2,2,2-trifluoro-1-methylethyl ester|2-Acetoxy-2-methyl-3,3,3-trifluoropropionitrile|J41.590A|Lactonitrile, 2-methyl-3,3,3-trifluoro-, acetate|Lactonitrile, 2-(trifluoromethyl)-, acetate|1-CYANO-2,2,2-TRIFLUORO-1-METHYLETHYL ACETATE|4-03-00-00796 (Beilstein Handbook Reference)|rac-2-cyano-1,1,1-trifluoroprop-2-yl acetate|Propionitrile, 2-hydroxy-2-methyl-3,3,3-trifluoro-, acetate|ACETIC ACID, 1-CYANO-2,2,2-TRIFLUORO-1-METHYLETHYL ESTER|Acetic acid, cyano-, 2,2,2-trifluoro-1-methylethyl ester
| Molecular Formula | C6H6F3NO2 |
|---|---|
| Molecular Weight | 181.03506 g/mol |
| LogP | 1.39 |
| Topological Polar Surface Area | 50.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.03506 |
| Heavy Atoms | 12 |
| Complexity | 229.9 |
Chemical Identifiers
| CAS Number | 4588-51-6 |
|---|---|
| SMILES | CC(=O)OC(C)(C#N)C(F)(F)F |
Product Overview
2-Cyano-1,1,1-trifluoropropan-2-yl acetate (CAS 4588-51-6), with molecular formula C6H6F3NO2 and molecular weight 181.03506 g/mol. IUPAC: (2-cyano-1,1,1-trifluoropropan-2-yl) acetate.
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