Basic information
- CAS
80149-84-4- Standard SMILES
CCC(=C(CC)c1cccc(OC(C)=O)c1)c1cccc(OC(C)=O)c1- InChIKey
BCJYOQZVKCFYCV-UHFFFAOYSA-N- Molecular formula
- C22H24O4
- Average molar mass
- 352.4 g/mol
- Monoisotopic mass
- 352.16745924
Names & identifiers
- Preferred name
- (Hex-3-ene-3,4-diyl)di(3,1-phenylene) diacetate
- IUPAC
- [3-[4-(3-acetyloxyphenyl)hex-3-en-3-yl]phenyl] acetate
Names & synonyms
DTXSID30120095980149-84-4(Hex-3-ene-3,4-diyl)di(3,1-phenylene) diacetatePhenol, 3,3a(2)-(1,2-diethyl-1,2-ethenediyl)bis-, diacetate
Database identifiers
- CAS
80149-84-4- PubChem CID
- 53674792
- DTXSID
DTXSID301200959
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 476
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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