2-(4-Nitrophenyl)-2-oxoethyl benzoate
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Basic information
- CAS
55153-34-9- Standard SMILES
O=C(COC(=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1- InChIKey
REQZMESHGQWDTF-UHFFFAOYSA-N- Molecular formula
- C15H11NO5
- Average molar mass
- 285.25 g/mol
- Monoisotopic mass
- 285.06372245
Names & identifiers
- Preferred name
- 2-(4-Nitrophenyl)-2-oxoethyl benzoate
- IUPAC
- [2-(4-nitrophenyl)-2-oxoethyl] benzoate
- English name
- Benzoic acid 2-oxo-2-(4-nitrophenyl)ethyl ester
- Molecular formula
- C15H11NO5
- Molecular weight
- 285.25
Names & synonyms
2-(4-Nitrophenyl)-2-oxoethyl benzoate55153-34-9DTXSID50341071RefChem:252763DTXCID70292152Benzoic acid 2-oxo-2-(4-nitrophenyl)ethyl esterEthanone, 2-(benzoyloxy)-1-(4-nitrophenyl)-REQZMESHGQWDTF-UHFFFAOYSA-NSTK727884AKOS0015681252-(4-Nitrophenyl)-2-oxoethyl benzoate #DB-296994
Show more names
Benzoic acid 4-nitrophenacyl ester
ST4025043
Database identifiers
- CAS
55153-34-9- PubChem CID
- 569788
- DTXSID
DTXSID50341071- Nikkaji
- J146.530I
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 89.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 389
Related reactions
0 records
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Compound notes
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