Basic information
- CAS
4164-34-5- Standard SMILES
CN(CCN(C)[N+](=O)[O-])[N+](=O)[O-]- InChIKey
HCAOFVZKSOXNQN-UHFFFAOYSA-N- Molecular formula
- C4H10N4O4
- Average molar mass
- 178.15 g/mol
- Monoisotopic mass
- 178.07020481
Names & identifiers
- Preferred name
- N1,N2-Dimethyl-N1,N2-dinitro-1,2-ethanediamine
- IUPAC
- N-methyl-N-[2-[methyl(nitro)amino]ethyl]nitramide
Names & synonyms
ETHYLENEDIAMINE, N,N'-DIMETHYL-N,N'-DINITRO-4164-34-5DTXSID40194457RefChem:1092153DTXCID50116948N1,N2-Dimethyl-N1,N2-dinitro-1,2-ethanediamineBRN 1788505N,N-Dimethyl-N,N'-dinitroethylenediamine2,5-dinitro-2,5-diazahexaneEthanediamine, N,N'-dimethyl-N,N'-dinitro-4-04-00-03412 (Beilstein Handbook Reference)SCHEMBL6124296
Show more names
METHYL({2-[METHYL(NITRO)AMINO]ETHYL})NITROAMINEAKOS000567486ST51168882N,N'-Ethane-1,2-diylbis(N-methylnitramide)
Database identifiers
- CAS
4164-34-5- PubChem CID
- 20123
- DTXSID
DTXSID40194457- Nikkaji
- J49.908K
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 98.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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