Basic information
- CAS
2900-65-4- Standard SMILES
CC=NNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1- InChIKey
JPYBBMYSLSEHAY-UHFFFAOYSA-N- Molecular formula
- C9H8N4O5
- Average molar mass
- 252.18 g/mol
- Monoisotopic mass
- 252.04946937
Names & identifiers
- Preferred name
- 3,5-Dinitrobenzoic acid 2-ethylidenehydrazide
- IUPAC
- N-(ethylideneamino)-3,5-dinitrobenzamide
Names & synonyms
3,5-Dinitrobenzoic acid 2-ethylidenehydrazideDTXSID8012543512900-65-4
Database identifiers
- CAS
2900-65-4- PubChem CID
- 4075321
- DTXSID
DTXSID801254351
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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