Basic information
- Standard SMILES
COC(=O)[C@@H](C(C)C)N1Cc2cc(Br)ccc2C1=O- InChIKey
RKSSYPVVHANURD-GFCCVEGCSA-N- Molecular formula
- C14H16BrNO3
- Average molar mass
- 326.19 g/mol
Names & identifiers
- Preferred name
- (R)-Methyl 2-(5-bromo-1-oxoisoindolin-2-yl)-3-methylbutanoate
- IUPAC
- methyl (2R)-2-(6-bromo-3-oxo-1H-isoindol-2-yl)-3-methylbutanoate
Names & synonyms
RKSSYPVVHANURD-GFCCVEGCSA-N(R)-Methyl 2-(5-bromo-1-oxoisoindolin-2-yl)-3-methylbutanoate
Database identifiers
- PubChem CID
- 86673568
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 372
Related reactions
11 records
Compound notes
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