Acetic acid, 2-ethoxy-, 2-oxo-2-[[4-(2-phenyldiazenyl)phenyl]amino]ethyl ester
Basic information
- CAS
562861-42-1- Standard SMILES
CCOCC(=O)OCC(=O)Nc1ccc(N=Nc2ccccc2)cc1- InChIKey
KAEWYSWCOMRQPR-UHFFFAOYSA-N- Molecular formula
- C18H19N3O4
- Average molar mass
- 341.4 g/mol
- Monoisotopic mass
- 341.1375561
Names & identifiers
- Preferred name
- Acetic acid, 2-ethoxy-, 2-oxo-2-[[4-(2-phenyldiazenyl)phenyl]amino]ethyl ester
- IUPAC
- [2-oxo-2-(4-phenyldiazenylanilino)ethyl] 2-ethoxyacetate
Names & synonyms
DTXSID501039057AKOS000862130AKOS030681142Acetic acid, 2-ethoxy-, 2-oxo-2-[[4-(2-phenyldiazenyl)phenyl]amino]ethyl ester562861-42-1Z18760104
Database identifiers
- CAS
562861-42-1- PubChem CID
- 8014509
- DTXSID
DTXSID501039057
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 89.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 442
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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