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Basic information
- Standard SMILES
C[C@](O)(CCl)CON1C(=O)c2ccccc2C1=O- InChIKey
MKAAKNSKKFKNRJ-LBPRGKRZSA-N- Molecular formula
- C12H12ClNO4
- Average molar mass
- 269.68 g/mol
Names & identifiers
- Preferred name
- 2-[[(2R)-3-Chloro-2-hydroxy-2-methylpropyl]oxy]-1H-isoindole-1,3(2H)-dione
- IUPAC
- 2-[(2R)-3-chloro-2-hydroxy-2-methylpropoxy]isoindole-1,3-dione
Names & synonyms
SCHEMBL4221177MKAAKNSKKFKNRJ-LBPRGKRZSA-N2-[[(2R)-3-Chloro-2-hydroxy-2-methylpropyl]oxy]-1H-isoindole-1,3 (2H)-dione2-[[(2R)-3-Chloro-2-hydroxy-2-methylpropyl]oxy]-1H-isoindole-1,3(2H)-dione
Database identifiers
- PubChem CID
- 68962011
Properties
Computed structural propertiesFilling in
- XLogP
- 1.1
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 338
Related reactions
2 records
Compound notes
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