Basic information
- CAS
84434-19-5- Standard SMILES
CCC=CCCOC(=O)CCCCC- InChIKey
RGACQXBDYBCJCY-UHFFFAOYSA-N- Molecular formula
- C12H22O2
- Average molar mass
- 198.3 g/mol
- Monoisotopic mass
- 198.16197994
Overview
Hex-3-en-1-yl hexanoate has been reported in Glycine max and Capsicum annuum with data available.
Names & identifiers
- Preferred name
- Hex-3-en-1-yl hexanoate
- IUPAC
- hex-3-enyl hexanoate
Names & synonyms
Hex-3-en-1-yl hexanoate84434-19-5DTXSID2047561RefChem:201148DTXCID0027561(z)-3-hexen-1-yl caproateSCHEMBL310614(E)-3-hexen-1-yl hexanoateAKOS028109393NS00090427
Database identifiers
- CAS
84434-19-5- PubChem CID
- 61895
- DTXSID
DTXSID2047561- EC Number
- 282-819-5
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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