Basic information
- Standard SMILES
COC(=O)C1(N2Cc3cc(Br)ccc3C2=O)CCCC1- InChIKey
BMKUPXVMZYTVNI-UHFFFAOYSA-N- Molecular formula
- C15H16BrNO3
- Average molar mass
- 338.2 g/mol
Names & identifiers
- Preferred name
- Methyl 1-(5-bromo-1-oxoisoindolin-2-yl)cyclopentanecarboxylate
- IUPAC
- methyl 1-(6-bromo-3-oxo-1H-isoindol-2-yl)cyclopentane-1-carboxylate
Names & synonyms
SCHEMBL2196473BMKUPXVMZYTVNI-UHFFFAOYSA-NMethyl 1-(5-bromo-1-oxoisoindolin-2-yl)cyclopentanecarboxylate
Database identifiers
- PubChem CID
- 67313405
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 419
Related reactions
4 records
Compound notes
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