Structure Info
- Chemspace ID
- CSSS00012772356 (In-Stock Screening Compounds)
- CAS
- 1369347-50-1
- MFCD
- MFCD22067485
- IUPAC Name
- 4-tert-butyl-1,3-oxazole-5-carboxylic acid
- Mol formula
- C8H11NO3
- Mol weight
- 169 Da
- Catalog Number(s)
- BB4LS-EN300-1602077, BBV-43549253, BI05220, CSC012772356, EN300-1602077, FCH1592943, Y3259825, Z1416198302
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.42
- Heavy atoms count
- 12
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 63
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00012772356
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