N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride
Basic information
- CAS
81417-00-7- Standard SMILES
F.[N-]=[N+]=Nc1ccc(C(=O)NCCN)c([N+](=O)[O-])c1- InChIKey
HHTZRZBEFXSVOP-UHFFFAOYSA-N- Molecular formula
- C9H11FN6O3
- Average molar mass
- 270.22 g/mol
- Monoisotopic mass
- 270.0876664
Names & identifiers
- Preferred name
- N-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluoride
- IUPAC
- N-(2-aminoethyl)-4-azido-2-nitrobenzamide;hydrofluoride
Names & synonyms
81417-00-7Benzamide, N-(2-aminoethyl)-4-azido-2-nitro-, monohydrofluorideN-(2-Aminoethyl)-4-azido-2-nitrobenzamide monohydrofluorideDTXSID20231091N-(2-Aminoethyl)-4-azido-2-nitrobenzamide--hydrogen fluoride (1/1)
Database identifiers
- CAS
81417-00-7- PubChem CID
- 3036558
- DTXSID
DTXSID20231091
Properties
Computed structural properties
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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