4-Biphenylol, 3,3'-dinitro-
Basic information
- CAS
97851-14-4- Standard SMILES
O=[N+]([O-])c1cccc(-c2ccc(O)c([N+](=O)[O-])c2)c1- InChIKey
SLRQNUOHLJYXRG-UHFFFAOYSA-N- Molecular formula
- C12H8N2O5
- Average molar mass
- 260.2 g/mol
- Monoisotopic mass
- 260.04332136
Names & identifiers
- Preferred name
- 4-Biphenylol, 3,3'-dinitro-
- IUPAC
- 2-nitro-4-(3-nitrophenyl)phenol
Names & synonyms
4-Hydroxy-3,3'-dinitrobiphenyl97851-14-4CCRIS 57664-BIPHENYLOL, 3,3'-DINITRO-BRN 5576283(1,1'-Biphenyl)-4-ol, 3,3'-dinitro-DTXSID50243288RefChem:290395DTXCID50165779SLRQNUOHLJYXRG-UHFFFAOYSA-N2-nitro-4-(3-nitrophenyl)phenol3,3'-Dinitro-4-biphenylol
Show more names
2-Nitro-4-(3-nitrophenyl)phenol, 95%MFCD017405643,3'-Dinitro[1,1'-biphenyl]-4-ol3,3'-Dinitro[1,1'-biphenyl]-4-ol #
Database identifiers
- CAS
97851-14-4- PubChem CID
- 57324
- DTXSID
DTXSID50243288- Nikkaji
- J599.960J
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 351
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Related reactions
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Compound notes
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