Basic information
- CAS
448906-43-2- Standard SMILES
COc1ccc(OC(=O)CN2C(=O)c3ccccc3C2=O)cc1- InChIKey
OTDBZSGDSNCHTM-UHFFFAOYSA-N- Molecular formula
- C17H13NO5
- Average molar mass
- 311.29 g/mol
- Monoisotopic mass
- 311.07937252
Names & identifiers
- Preferred name
- 4-methoxyphenyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
- IUPAC
- (4-methoxyphenyl) 2-(1,3-dioxoisoindol-2-yl)acetate
Names & synonyms
4-methoxyphenyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate448906-43-2Oprea1_617981(4-methoxyphenyl) 2-(1,3-dioxoisoindol-2-yl)acetateDTXSID901185199STK257835AKOS002956761CCG-350435SR-01000262770SR-01000262770-14-Methoxyphenyl 1,3-dihydro-1,3-dioxo-2H-isoindole-2-acetate
Database identifiers
- CAS
448906-43-2- PubChem CID
- 890891
- DTXSID
DTXSID901185199
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 459
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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