Basic information
- CAS
121441-39-2- Standard SMILES
CC/C=C/CCOCc1ccccc1- InChIKey
PCHRJGRKKJOULQ-ONEGZZNKSA-N- Molecular formula
- C13H18O
- Average molar mass
- 190.28 g/mol
- Monoisotopic mass
- 190.13576519
Names & identifiers
- Preferred name
- [(E)-hex-3-enoxy]methylbenzene
- IUPAC
- [(E)-hex-3-enoxy]methylbenzene
Names & synonyms
[(E)-hex-3-enoxy]methylbenzene121441-39-2(3E)-1-Benzyloxyhex-3-enetrans-1-(Benzyloxy)-3-hexeneSCHEMBL1586913054M33R4X5Y[[(3E)-3-Hexen-1-yloxy]methyl]benzeneBenzene, [[(3E)-3-hexen-1-yloxy]methyl]-
Database identifiers
- CAS
121441-39-2- PubChem CID
- 6366131
- UNII
- 54M33R4X5Y
- Nikkaji
- J1.857.292C、J741.588E
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 145
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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