1,1'-Biphenyl, 2,2',4,6'-tetranitro-
Basic information
- CAS
106323-82-4- Standard SMILES
O=[N+]([O-])c1ccc(-c2c([N+](=O)[O-])cccc2[N+](=O)[O-])c([N+](=O)[O-])c1- InChIKey
SUGAJDLLCZMTPY-UHFFFAOYSA-N- Molecular formula
- C12H6N4O8
- Average molar mass
- 334.2 g/mol
- Monoisotopic mass
- 334.01856316
Names & identifiers
- Preferred name
- 1,1'-Biphenyl, 2,2',4,6'-tetranitro-
- IUPAC
- 2-(2,4-dinitrophenyl)-1,3-dinitrobenzene
Names & synonyms
1,1'-BIPHENYL, 2,2',4,6'-TETRANITRO-106323-82-42,4,2',6'-TetranitrobiphenylCHEMBL352580SCHEMBL1569222DTXSID301475732,2',4,6'-TETRANITRO-1,1'-BIPHENYL
Database identifiers
- CAS
106323-82-4- PubChem CID
- 60131
- DTXSID
DTXSID30147573- ChEMBL
CHEMBL352580
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 183 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 511
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Compound notes
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