Structure Info
- Chemspace ID
- CSMB03437849882 (Enamine MADE)
- CAS
- 2639456-14-5
- IUPAC Name
- ethyl 4-amino-2-(2,5,5-trimethyl-1,3-dioxan-2-yl)benzoate
- Mol formula
- C16H23NO4
- Mol weight
- 293 Da
- Catalog Number(s)
- EN300-27723257
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.77
- Heavy atoms count
- 21
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.562
- Polar surface area (Å)
- 71
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB03437849882
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