Methyl 3-(2,3-dimethoxyphenyl)-1,2-oxazole-5-carboxylate
Basic information
- CAS
330558-50-4- Standard SMILES
COC(=O)c1cc(-c2cccc(OC)c2OC)no1- InChIKey
LAZRKLZGIKVBDC-UHFFFAOYSA-N- Molecular formula
- C13H13NO5
- Average molar mass
- 263.25 g/mol
- Monoisotopic mass
- 263.07937252
Names & identifiers
- Preferred name
- Methyl 3-(2,3-dimethoxyphenyl)-1,2-oxazole-5-carboxylate
- IUPAC
- methyl 3-(2,3-dimethoxyphenyl)-1,2-oxazole-5-carboxylate
Names & synonyms
methyl 3-(2,3-dimethoxyphenyl)-1,2-oxazole-5-carboxylatemethyl 3-(2,3-dimethoxyphenyl)isoxazole-5-carboxylateDTXSID201214866STL329285AKOS000672277330558-50-4EU-0004351ST50270976SR-01000427403SR-01000427403-1Methyl 3-(2,3-dimethoxyphenyl)-5-isoxazolecarboxylate
Database identifiers
- CAS
330558-50-4- PubChem CID
- 776535
- DTXSID
DTXSID201214866
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 70.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 311
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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