Basic information
- CAS
35559-12-7- Standard SMILES
CCOC(=O)NN=Cc1cccc([N+](=O)[O-])c1- InChIKey
CQWPMNIIIQFFKB-UHFFFAOYSA-N- Molecular formula
- C10H11N3O4
- Average molar mass
- 237.21 g/mol
- Monoisotopic mass
- 237.07495584
Names & identifiers
- Preferred name
- Ethyl hydrogen [(3-nitrophenyl)methylidene]carbonohydrazonate
- IUPAC
- ethyl N-[(3-nitrophenyl)methylideneamino]carbamate
Names & synonyms
DTXSID40956951Ethyl hydrogen [(3-nitrophenyl)methylidene]carbonohydrazonate
Database identifiers
- CAS
35559-12-7- PubChem CID
- 276017
- DTXSID
DTXSID40956951
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…