2,5-Dimethyl-3-furancarboxylic acid 2-[(4-nitrophenyl)methylene]hydrazide
Basic information
- CAS
159881-96-6- Standard SMILES
Cc1cc(C(=O)NN=Cc2ccc([N+](=O)[O-])cc2)c(C)o1- InChIKey
KNKOMASVXMDLMF-UHFFFAOYSA-N- Molecular formula
- C14H13N3O4
- Average molar mass
- 287.27 g/mol
- Monoisotopic mass
- 287.0906059
Names & identifiers
- Preferred name
- 2,5-Dimethyl-3-furancarboxylic acid 2-[(4-nitrophenyl)methylene]hydrazide
- IUPAC
- 2,5-dimethyl-N-[(4-nitrophenyl)methylideneamino]furan-3-carboxamide
Names & synonyms
2,5-dimethyl-N'-[(4-nitrophenyl)methylidene]furan-3-carbohydrazideDTXSID001146558HMS2643B142,5-Dimethyl-3-furancarboxylic acid 2-[(4-nitrophenyl)methylene]hydrazide159881-96-6
Database identifiers
- CAS
159881-96-6- PubChem CID
- 760434
- DTXSID
DTXSID001146558
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 413
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Compound notes
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