o-(N-t-butoxycarbonyl-N-methylaminomethyl)phenylacetic acid
Basic information
- Standard SMILES
CN(Cc1ccccc1CC(=O)O)C(=O)OC(C)(C)C- InChIKey
DSRNLRMXFCOAGP-UHFFFAOYSA-N- Molecular formula
- C15H21NO4
- Average molar mass
- 279.33 g/mol
Names & identifiers
- Preferred name
- o-(N-t-butoxycarbonyl-N-methylaminomethyl)phenylacetic acid
- IUPAC
- 2-[2-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]phenyl]acetic acid
Names & synonyms
SCHEMBL11470297SCHEMBL29430479DSRNLRMXFCOAGP-UHFFFAOYSA-No-(N-t-butoxycarbonyl-N-methylaminomethyl)phenylacetic acid
Database identifiers
- PubChem CID
- 20344367
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
Related reactions
3 records
Compound notes
Loading…