1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propyl acetate
Chemical Structure Depiction of
1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propyl acetate
1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propyl acetate
Compound characteristics
| Compound ID: | 8014-0242 |
| Compound Name: | 1-(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)propyl acetate |
| Molecular Weight: | 281.26 |
| Molecular Formula: | C13 H15 N O6 |
| Smiles: | CCC(c1cc2c(cc1[N+]([O-])=O)OCCO2)OC(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3511 |
| logD: | 1.3511 |
| logSw: | -1.6832 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.546 |
| InChI Key: | NVRQCSAIOZHSQA-NSHDSACASA-N |