Basic information
- Standard SMILES
CCCCc1ccc(-c2ccccc2C2=NC(C)(C)CO2)cc1- InChIKey
KYBSVRQTUCJIJA-UHFFFAOYSA-N- Molecular formula
- C21H25NO
- Average molar mass
- 307.4 g/mol
Names & identifiers
- Preferred name
- 2-(4,4-Dimethyl-2-oxazolin-2-yl)-4'-n-butylbiphenyl
- IUPAC
- 2-[2-(4-butylphenyl)phenyl]-4,4-dimethyl-5H-1,3-oxazole
Names & synonyms
SCHEMBL10834895KYBSVRQTUCJIJA-UHFFFAOYSA-N2-(4,4-dimethyl-2-oxazolin-2-yl)-4'-n-butylbiphenyl
Database identifiers
- PubChem CID
- 13629279
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 406
Related reactions
2 records
Compound notes
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