1-Pyrrolidineacetonitrile,a-1,3-benzodioxol-5-yl- structure
|
Common Name | 1-Pyrrolidineacetonitrile,a-1,3-benzodioxol-5-yl- | ||
|---|---|---|---|---|
| CAS Number | 37673-03-3 | Molecular Weight | 230.26200 | |
| Density | 1.279g/cm3 | Boiling Point | 338.8ºC at 760mmHg | |
| Molecular Formula | C13H14N2O2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 158.7ºC | |
| Name | 2-(1,3-benzodioxol-5-yl)-2-pyrrolidin-1-ylacetonitrile |
|---|---|
| Synonym | More Synonyms |
| Density | 1.279g/cm3 |
|---|---|
| Boiling Point | 338.8ºC at 760mmHg |
| Molecular Formula | C13H14N2O2 |
| Molecular Weight | 230.26200 |
| Flash Point | 158.7ºC |
| Exact Mass | 230.10600 |
| PSA | 45.49000 |
| LogP | 2.01368 |
| Index of Refraction | 1.604 |
| InChIKey | AXNHBGUUQZQXLN-UHFFFAOYSA-N |
| SMILES | N#CC(c1ccc2c(c1)OCO2)N1CCCC1 |
|
~52%
1-Pyrrolidineac... CAS#:37673-03-3 |
| Literature: Carreno Otero, Aurora L.; Vargas Mendez, Leonor Y.; Duque L., Jonny E.; Kouznetsov, Vladimir V. European Journal of Medicinal Chemistry, 2014 , vol. 78, p. 392 - 400 |
| Precursor 3 | |
|---|---|
| DownStream 0 | |
| benzo[1,3]dioxol-5-yl-pyrrolidin-1-yl-acetonitrile |
| 2-(3,4-dioxymethylenphenyl)-2-(pyrrolidin-1-yl)acetonitrile |
| Piperonyl-pyrrolidyl-essigsaeure-nitril |