Basic information
- Standard SMILES
COC(=O)[C@@H]1NC(=O)[C@@H]1NC(=O)OC(C)(C)C- InChIKey
PEHFXRUQRNFCIN-PHDIDXHHSA-N- Molecular formula
- C10H16N2O5
- Average molar mass
- 244.24 g/mol
Names & identifiers
- Preferred name
- Methyl cis-3-t-butoxycarbonylamino-4-oxoazetidine-2-carboxylate
- IUPAC
- methyl (2R,3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxoazetidine-2-carboxylate
Names & synonyms
SCHEMBL10721576PEHFXRUQRNFCIN-PHDIDXHHSA-Nmethyl cis-3-t-butoxycarbonylamino-4-oxoazetidine-2-carboxylate
Database identifiers
- PubChem CID
- 70428372
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 93.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 347
Related reactions
8 records
Compound notes
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