Basic information
- Standard SMILES
COCCc1nc(C(=O)O)c(-c2ccccc2)o1- InChIKey
VPGFVSBLQVMNAD-UHFFFAOYSA-N- Molecular formula
- C13H13NO4
- Average molar mass
- 247.25 g/mol
Names & identifiers
- Preferred name
- 2-(2-Methoxy-ethyl)-5-phenyl-oxazole-4-carboxylic acid
- IUPAC
- 2-(2-methoxyethyl)-5-phenyl-1,3-oxazole-4-carboxylic acid
Names & synonyms
2-(2-methoxy-ethyl)-5-phenyl-oxazole-4-carboxylic acidSCHEMBL1166842VPGFVSBLQVMNAD-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 66928802
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 278
Related reactions
5 records
Compound notes
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