Structure Info
- Chemspace ID
- CSCS00010998301 (Synthesis)
- MFCD
- MFCD27940260
- IUPAC Name
- tert-butyl (2E)-2-[2-(benzyloxy)-2-oxoethylidene]azepane-1-carboxylate
- Mol formula
- C20H27NO4
- Mol weight
- 345 Da
- Catalog Number(s)
- BBV-78563111, CSC010998301, FCH3129931, LN00311209, PBMR200508
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.14
- Heavy atoms count
- 25
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 56
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00010998301
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