Structure Info
- Chemspace ID
- CSMB00102711457 (Enamine MADE)
- CAS
- 2138138-91-5
- MFCD
- MFCD31440480
- IUPAC Name
- chloromethyl 3-{[(tert-butoxy)carbonyl]amino}-3-(3-nitrophenyl)propanoate
- Mol formula
- C15H19ClN2O6
- Mol weight
- 359 Da
- Catalog Number(s)
- BBV-118327805, CSC102711457, EN300-719090
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.07
- Heavy atoms count
- 24
- Rotatable bond count
- 9
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.466
- Polar surface area (Å)
- 108
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00102711457
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