Basic information
- CAS
1030-08-6- Standard SMILES
CCCCCCCCc1cc(-c2ccccc2)no1- InChIKey
PLILCSUYIUBKNG-UHFFFAOYSA-N- Molecular formula
- C17H23NO
- Average molar mass
- 257.37 g/mol
- Monoisotopic mass
- 257.17796436
Names & identifiers
- Preferred name
- 5-Octyl-3-phenyl-1,2-oxazole
- IUPAC
- 5-octyl-3-phenyl-1,2-oxazole
Names & synonyms
5-Octyl-3-phenylisoxazole1030-08-65-OCTYL-3-PHENYL-1,2-OXAZOLESCHEMBL28659027DTXSID30495142
Database identifiers
- CAS
1030-08-6- PubChem CID
- 12376597
- DTXSID
DTXSID30495142
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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