Benzophenone, 2,4-dihydroxy-4'-nitro-
Basic information
- CAS
6994-40-7- Standard SMILES
O=C(c1ccc([N+](=O)[O-])cc1)c1ccc(O)cc1O- InChIKey
SGDKXQGGKPQZGD-UHFFFAOYSA-N- Molecular formula
- C13H9NO5
- Average molar mass
- 259.21 g/mol
- Monoisotopic mass
- 259.04807239
Names & identifiers
- Preferred name
- Benzophenone, 2,4-dihydroxy-4'-nitro-
- IUPAC
- (2,4-dihydroxyphenyl)-(4-nitrophenyl)methanone
Names & synonyms
NSC1379286994-40-7Benzophenone, 2,4-dihydroxy-4'-nitro-SCHEMBL26927727DTXSID50300628NSC-137928(2,4-dihydroxyphenyl)(4-nitrophenyl)methanone
Database identifiers
- CAS
6994-40-7- PubChem CID
- 283373
- DTXSID
DTXSID50300628
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 345
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Related reactions
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Compound notes
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