Ethyl 4-[(4-hexoxyphenyl)methylideneamino]benzoate
Basic information
- CAS
37168-43-7- Standard SMILES
CCCCCCOc1ccc(C=Nc2ccc(C(=O)OCC)cc2)cc1- InChIKey
NCUKICSZOYPWEA-UHFFFAOYSA-N- Molecular formula
- C22H27NO3
- Average molar mass
- 353.5 g/mol
- Monoisotopic mass
- 353.19909372
Names & identifiers
- Preferred name
- Ethyl 4-[(4-hexoxyphenyl)methylideneamino]benzoate
- IUPAC
- ethyl 4-[(4-hexoxyphenyl)methylideneamino]benzoate
Names & synonyms
37168-43-7ethyl 4-[(4-hexoxyphenyl)methylideneamino]benzoateNSC171016DTXSID30305515AKOS004908208NSC-171016ETHYL 4-[(E)-{[4-(HEXYLOXY)PHENYL]METHYLIDENE}AMINO]BENZOATE
Database identifiers
- CAS
37168-43-7- PubChem CID
- 298705
- DTXSID
DTXSID30305515
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 408
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Compound notes
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