Basic information
- CAS
305377-30-4- Standard SMILES
CCOC(=O)c1ccccc1NC(=O)CCN1C(=O)c2ccccc2C1=O- InChIKey
AHOFADQSCCHIRX-UHFFFAOYSA-N- Molecular formula
- C20H18N2O5
- Average molar mass
- 366.4 g/mol
- Monoisotopic mass
- 366.12157168
Names & identifiers
- Preferred name
- Ethyl 2-(3-(1,3-dioxoisoindolin-2-yl)propanamido)benzoate
- IUPAC
- ethyl 2-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]benzoate
Names & synonyms
305377-30-4Ethyl 2-(3-(1,3-dioxoisoindolin-2-yl)propanamido)benzoateethyl 2-[3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanamido]benzoateOprea1_510939Oprea1_527228CBDivE_001630HMS1608P21AKOS000536263SB65918ST50181866AF-399/32479005SR-01000405649
Show more names
SR-01000405649-1Ethyl2-(3-(1,3-dioxoisoindolin-2-yl)propanamido)benzoateethyl 2-[3-(1,3-dioxobenzo[c]azolidin-2-yl)propanoylamino]benzoateethyl 2-[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamido]benzoate2-(3-(1,3-DIOXO-1,3-2H-ISOINDOL-2-YL)-PROPIONYLAMINO)-BENZOIC ACID ETHYL ESTERethyl 2-{[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoyl]amino}benzoate
Database identifiers
- CAS
305377-30-4- PubChem CID
- 989237
- EC Number
- 119-380-5
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 581
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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