Basic information
- CAS
56752-54-6- Standard SMILES
CC=CC=CCOCC- InChIKey
UNHPVHFNZXRVNU-UHFFFAOYSA-N- Molecular formula
- C8H14O
- Average molar mass
- 126.2 g/mol
- Monoisotopic mass
- 126.10446507
Names & identifiers
- Preferred name
- 2,4-Hexadiene, 1-ethoxy-
- IUPAC
- 1-ethoxyhexa-2,4-diene
Names & synonyms
2,4-Hexadiene, 1-ethoxy-56752-54-6DTXSID70336146RefChem:246739DTXCID202872351-ETHOXYHEXA-2,4-DIENESCHEMBL11580784SCHEMBL11762239
Database identifiers
- CAS
56752-54-6- PubChem CID
- 529316
- DTXSID
DTXSID70336146
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 92.7
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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