Structure Info
- Chemspace ID
- CSCS00011184660 (Synthesis)
- MFCD
- MFCD23141006
- IUPAC Name
- 2-benzyl-3-(benzyloxy)-3-oxopropane-1-sulfonic acid
- Mol formula
- C17H18O5S
- Mol weight
- 334 Da
- Catalog Number(s)
- BBV-77985430, CSC011184660, FCH3183068, QMC81853
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.9
- Heavy atoms count
- 23
- Rotatable bond count
- 8
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.235
- Polar surface area (Å)
- 81
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS00011184660
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