Basic information
- Standard SMILES
COC(=O)c1ccc(-c2ccccc2C2=NC(C)(C)CO2)cc1- InChIKey
QLAREQODRURBIO-UHFFFAOYSA-N- Molecular formula
- C19H19NO3
- Average molar mass
- 309.4 g/mol
Names & identifiers
- Preferred name
- 4,4-Dimethyl-2-(4'-methoxycarbonylbiphenyl-2-yl)oxazoline
- IUPAC
- methyl 4-[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]benzoate
Names & synonyms
SCHEMBL8873929QLAREQODRURBIO-UHFFFAOYSA-N4,4-dimethyl-2-(4'-methoxycarbonylbiphenyl-2-yl)oxazoline4.4-dimethyl-2-(4'-methoxycarbonylbiphenyl -2-yl)oxazoline
Database identifiers
- PubChem CID
- 15380877
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 463
Related reactions
16 records
Compound notes
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