2,5-Dimethyldinitrosopiperazine
Basic information
- CAS
55556-88-2- Standard SMILES
CC1CN(N=O)C(C)CN1N=O- InChIKey
ZDRKXNMKZRFCCW-UHFFFAOYSA-N- Molecular formula
- C6H12N4O2
- Average molar mass
- 172.19 g/mol
- Monoisotopic mass
- 172.09602564
Names & identifiers
- Preferred name
- 2,5-Dimethyldinitrosopiperazine
- IUPAC
- 2,5-dimethyl-1,4-dinitrosopiperazine
- English name
- Piperazine, 2,5-dimethyl-1,4-dinitroso- (6CI,9CI)
- Molecular formula
- C6H12N4O2
- Molecular weight
- 172.19
Names & synonyms
2,5-Dimethyl-1,4-dinitrosopiperazine2,5-Dimethyldinitrosopiperazine55556-88-22,5-Dimethyl-dnpzDinitroso-2,5-dimethylpiperazinePIPERAZINE, 2,5-DIMETHYL-1,4-DINITROSO-NSC 86956NSC86956NCIOpen2_001275CHEMBL434869DTXSID908756282,5-dimethyl-dinitroso-piperazine
Show more names
1,4-Dinitroso-2,5-dimethylpiperazinePiperazine, 2,5-dimethyl-1,4-dinitroso- (6CI,9CI)
ZDRKXNMKZRFCCW-UHFFFAOYSA-NNSC-86956AKOS006276805Piperazine,5-dimethyl-1,4-dinitroso-2,5-Dimethyl-1,4-dinitrosopiperazine #2,5-DIME-N,N'-DINITROSOPIPERAZINEDB-288712
Database identifiers
- CAS
55556-88-2- PubChem CID
- 41468
- DTXSID
DTXSID90875628- ChEMBL
CHEMBL434869- Nikkaji
- J1.072C
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 65.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 166
Experimental & physicochemical properties
LogP0.15
Physicochemical properties
- Boiling point
- 305.18 °C · 305.18°C (rough estimate)
- Density
- 1.2297 · 1.2297 (rough estimate)
- refractive index
- 1.67 · 1.6700 (estimate)
- pka
- -4.78 · -4.78±0.70(Predicted)
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Compound notes
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