2-Benzoyl-3-nitrobenzoic acid
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Basic information
- CAS
7335-60-6- Standard SMILES
O=C(O)c1cccc([N+](=O)[O-])c1C(=O)c1ccccc1- InChIKey
VQCAQTNPROLAJK-UHFFFAOYSA-N- Molecular formula
- C14H9NO5
- Average molar mass
- 271.22 g/mol
- Monoisotopic mass
- 271.04807239
Names & identifiers
- Preferred name
- 2-Benzoyl-3-nitrobenzoic acid
- IUPAC
- 2-benzoyl-3-nitrobenzoic acid
- English name
- 2-Benzoyl-3-nitrobenzoic acid
- Molecular weight
- 0
Names & synonyms
2-benzoyl-3-nitrobenzoic acid7335-60-6DTXSID60303625RefChem:256455DTXCID90254757NSC159430nitro 2-benzoylbenzoic acidSCHEMBL5307875VQCAQTNPROLAJK-UHFFFAOYSA-NNSC-159430
Database identifiers
- CAS
7335-60-6- PubChem CID
- 293114
- DTXSID
DTXSID60303625- Nikkaji
- J81.374E
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 397
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Related reactions
1 records
Compound notes
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