Methyl 5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxylate
Structure Info
- Chemspace ID
- CSMB00021099840 (Enamine MADE)
- MFCD
- MFCD28532492
- IUPAC Name
- methyl 5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxylate
- Mol formula
- C11H13NO4
- Mol weight
- 223 Da
- Catalog Number(s)
- BBV-78446189, CSC021099840, FCH4131888
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.34
- Heavy atoms count
- 16
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.54545454545455
- Polar surface area (Å)
- 69
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00021099840
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