| Catalog Number | ACM187806173-1 |
| CAS | 187806-17-3 |
| IUPAC Name | [(E)-5-acetyloxypent-3-enyl] acetate |
| Synonyms | Pent-2-ene-1,5-diyl diacetate;Diacetic acid (E)-2-pentene-1,5-diyl ester;187806-17-3 |
| Molecular Weight | 186.20g/mol |
| Molecular Formula | C9H14O4 |
| Canonical SMILES | CC(=O)OCCC=CCOC(=O)C |
| InChI | InChI=1S/C9H14O4/c1-8(10)12-6-4-3-5-7-13-9(2)11/h3-4H,5-7H2,1-2H3/b4-3+ |
| InChI Key | OLSFTXUJEVKHAU-ONEGZZNKSA-N |
| Complexity | 196 |
| Covalently-Bonded Unit Count | 1 |
| Exact Mass | 186.08920892g/mol |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Monoisotopic Mass | 186.08920892g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 52.6Ų |
| X Log P3 | 0.8 |