1-(3-Ethyl-5-methyl-4-isoxazolyl)-1-ethanone phenyl hydrazone
Basic information
- CAS
80565-39-5- Standard SMILES
CCc1noc(C)c1C(C)=NNc1ccccc1- InChIKey
DZSRDHQUZINAAH-UHFFFAOYSA-N- Molecular formula
- C14H17N3O
- Average molar mass
- 243.3 g/mol
- Monoisotopic mass
- 243.13716217
Names & identifiers
- Preferred name
- 1-(3-Ethyl-5-methyl-4-isoxazolyl)-1-ethanone phenyl hydrazone
- IUPAC
- N-[1-(3-ethyl-5-methyl-1,2-oxazol-4-yl)ethylideneamino]aniline
Names & synonyms
SCHEMBL10978733DZSRDHQUZINAAH-UHFFFAOYSA-NDTXSID8011881881-(3-ethyl-5-methyl-4-isoxazolyl)-1-ethanone phenyl hydrazone1-(3-Ethyl-5-methyl-4-isoxazolyl)ethanone 2-phenylhydrazone3-Ethyl-5-methyl-4-[1-(2-phenylhydrazinylidene)ethyl]-1,2-oxazole80565-39-5
Database identifiers
- CAS
80565-39-5- PubChem CID
- 73176643
- DTXSID
DTXSID801188188
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 287
Related reactions
8 records
Compound notes
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