Ethyl 2-(1,3-dioxoisoindol-2-yl)propanoate
Basic information
- CAS
61020-64-2- Standard SMILES
CCOC(=O)C(C)N1C(=O)c2ccccc2C1=O- InChIKey
GGAXLKHQCAECFL-UHFFFAOYSA-N- Molecular formula
- C13H13NO4
- Average molar mass
- 247.25 g/mol
- Monoisotopic mass
- 247.0844579
Names & identifiers
- Preferred name
- Ethyl 2-(1,3-dioxoisoindol-2-yl)propanoate
- IUPAC
- ethyl 2-(1,3-dioxoisoindol-2-yl)propanoate
Names & synonyms
ethyl 2-(1,3-dioxoisoindol-2-yl)propanoate61020-64-2DTXSID70308085RefChem:342336DTXCID40259212Ethyl 2-(1,3-dioxoisoindolin-2-yl)propanoate14380-86-0NSC202017SCHEMBL917955ethyl 2-phthalimido-propionateSCHEMBL31483318GGAXLKHQCAECFL-UHFFFAOYSA-N
Show more names
NSC-202017DB-095932DS-007670Ethyl 2-(1,3-dioxo-1,3-dihydroisoindol-2-yl)propionateEthyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate
Database identifiers
- CAS
61020-64-2- PubChem CID
- 305258
- DTXSID
DTXSID70308085- Nikkaji
- J955.052F
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 355
Related reactions
2 records
Compound notes
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