Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(-c2ccc([N+](=O)[O-])cc2CO)cc1- InChIKey
MEACKFLYCHSFCK-UHFFFAOYSA-N- Molecular formula
- C13H10N2O5
- Average molar mass
- 274.23 g/mol
Names & identifiers
- Preferred name
- hydroxymethyl-4,4'-Dinitro 1,1'-biphenyl
- IUPAC
- [5-nitro-2-(4-nitrophenyl)phenyl]methanol
Names & synonyms
SCHEMBL28626894MEACKFLYCHSFCK-UHFFFAOYSA-Nhydroxymethyl-4,4'-Dinitro 1,1'-biphenyl
Database identifiers
- PubChem CID
- 86625101
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 357
Related reactions
3 records
Compound notes
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