Basic information
- CAS
86111-62-8- Standard SMILES
O=[N+]([O-])c1cnn(Cn2cc([N+](=O)[O-])cn2)c1- InChIKey
PWKYKRGSXDRYOB-UHFFFAOYSA-N- Molecular formula
- C7H6N6O4
- Average molar mass
- 238.16 g/mol
- Monoisotopic mass
- 238.04505269
Names & identifiers
- Preferred name
- Pyrazole, methylenebis(4-nitro-
- IUPAC
- 4-nitro-1-[(4-nitropyrazol-1-yl)methyl]pyrazole
Names & synonyms
86111-62-8Pyrazole, methylenebis(4-nitro-4,4'-Dinitro-1,1'-methylene-dipyrazoleNSC 373758BRN 06231201H-Pyrazole, 1,1'-methylenebis(4-nitro-DTXSID802353981H-Pyrazole, 1,1'-methylenebis[4-nitro-RefChem:376115DTXCID801578894-nitro-1-[(4-nitropyrazol-1-yl)methyl]pyrazoleBis(4-nitro-1H-pyrazol-1-yl)methane
Show more names
4-NITRO-1-[(4-NITRO-1H-PYRAZOL-1-YL)METHYL]-1H-PYRAZOLENSC-3737581,1'-Methylenebis(4-nitro-1H-pyrazole)1,1'-Methylenebis[4-nitro-1H-pyrazole]4-nitro-1-[(4-nitropyrazolyl)methyl]pyrazoleMFCD00812310NSC373758VT4JE4UN6G
Database identifiers
- CAS
86111-62-8- PubChem CID
- 100810
- DTXSID
DTXSID80235398- UNII
- VT4JE4UN6G
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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