Basic information
- CAS
115542-15-9- Standard SMILES
CCCCCCOCCc1ccccc1- InChIKey
XPYBDKANTPZPAM-UHFFFAOYSA-N- Molecular formula
- C14H22O
- Average molar mass
- 206.32 g/mol
- Monoisotopic mass
- 206.16706532
Names & identifiers
- Preferred name
- [2-(Hexyloxy)ethyl]benzene
- IUPAC
- 2-hexoxyethylbenzene
Names & synonyms
[2-(Hexyloxy)ethyl]benzeneSCHEMBL1580318SCHEMBL2761591SCHEMBL6538596SCHEMBL7305774DTXSID401311179115542-15-9
Database identifiers
- CAS
115542-15-9- PubChem CID
- 53675504
- DTXSID
DTXSID401311179- Nikkaji
- J3.371.777F
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 127
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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