Trans-2-Hexenyl acetate 98%

Chemical Information
(E)-hex-2-enyl acetate is an acetate ester resulting from the formal condensation of the hydroxy group of (E)-hex-2-en-1-ol with the carboxy group of acetic acid. It has a role as a flavouring agent and a plant metabolite. It is an acetate ester and an olefinic compound. It is functionally related to an (E)-hex-2-en-1-ol.
| CAS Number | 2497-18-9 |
| PubChem CID | 2733294 |
| IUPAC Name | [(E)-hex-2-enyl] acetate |
| Molecular Formula | C8H14O2 |
| Molecular Weight | 142.20 |
| XLogP | 2 |
| Topological Polar Surface Area | 26.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 116 |
| Property | Value |
|---|---|
| Molecular Weight | 142.20 |
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 142.099379685 |
| Monoisotopic Mass | 142.099379685 |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 116 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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