5,7-Dodecadienyl acetate
Basic information
- CAS
88159-34-6- Standard SMILES
CCCCC=CC=CCCCCOC(C)=O- InChIKey
LILNZTGQAGPWKK-UHFFFAOYSA-N- Molecular formula
- C14H24O2
- Average molar mass
- 224.34 g/mol
- Monoisotopic mass
- 224.17763
Overview
structure in first source
Names & identifiers
- Preferred name
- 5,7-Dodecadienyl acetate
- IUPAC
- dodeca-5,7-dienyl acetate
- English name
- Acetic acid 5,7-dodecadienyl ester
- Molecular formula
- C14H24O2
- Molecular weight
- 224.34
Names & synonyms
5,7-dodecadienyl acetateRefChem:91301188159-34-6dodeca-5,7-dienyl acetateSCHEMBL1301093DTXSID3013068065,7-Dodecadien-1-ol, 1-acetateDODECA-5,7-DIEN-1-YL ACETATE5,7-Dodecadien-1-ol acetateAcetic acid 5,7-dodecadienyl ester
Database identifiers
- CAS
88159-34-6- PubChem CID
- 538039
- DTXSID
DTXSID301306806
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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