Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1C[C@H](c2ccccc2)C1C(=O)O- InChIKey
HXVYFISMZPHYRM-JHJMLUEUSA-N- Molecular formula
- C15H19NO4
- Average molar mass
- 277.31 g/mol
Names & identifiers
- Preferred name
- (3S)-1-(tert-butoxycarbonyl)-3-phenylazetidine-2-carboxylic acid
- IUPAC
- (3S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-3-phenylazetidine-2-carboxylic acid
Names & synonyms
SCHEMBL15054715HXVYFISMZPHYRM-JHJMLUEUSA-N(3S)-1-(tert-butoxycarbonyl)-3-phenylazetidine-2-carboxylic acid
Database identifiers
- PubChem CID
- 89647751
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 382
Related reactions
1 records
Compound notes
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