2-[[(E)-N'-nitrocarbamimidoyl]-nitrosoamino]ethyl acetate
Basic information
- CAS
64365-36-2- Standard SMILES
CC(=O)OCCN(N=O)/C(N)=N/[N+](=O)[O-]- InChIKey
BOWWVROAKBNUTE-UHFFFAOYSA-N- Molecular formula
- C5H9N5O5
- Average molar mass
- 219.16 g/mol
- Monoisotopic mass
- 219.0603684
Names & identifiers
- Preferred name
- 2-[[(E)-N'-nitrocarbamimidoyl]-nitrosoamino]ethyl acetate
- IUPAC
- 2-[[(E)-N'-nitrocarbamimidoyl]-nitrosoamino]ethyl acetate
Names & synonyms
NSC35907NSC-35907
Database identifiers
- CAS
64365-36-2- PubChem CID
- 9577147
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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