N-(2-hydroxy-2-methylpropyl)-3-nitrobenzamide
Basic information
- CAS
6332-97-4- Standard SMILES
CC(C)(O)CNC(=O)c1cccc([N+](=O)[O-])c1- InChIKey
DZGDQIKUUIVZQD-UHFFFAOYSA-N- Molecular formula
- C11H14N2O4
- Average molar mass
- 238.24 g/mol
- Monoisotopic mass
- 238.09535693
Names & identifiers
- Preferred name
- N-(2-hydroxy-2-methylpropyl)-3-nitrobenzamide
- IUPAC
- N-(2-hydroxy-2-methylpropyl)-3-nitrobenzamide
Names & synonyms
N-(2-hydroxy-2-methylpropyl)-3-nitrobenzamide6332-97-4Benzamide, N-(2-hydroxy-2-methylpropyl)-3-nitro-NSC38780Cambridge id 6334124N-(2-Hydroxy-2-methyl-propyl)-3-nitro-benzamideOprea1_393334Oprea1_499809DTXSID40284741NSC-38780STL361469AKOS000623796
Show more names
N-(2-Hydroxyisobutyl)-m-nitrobenzamideST50014368AG-690/15429495N-(2-hydroxy-2-methylpropyl)(3-nitrophenyl)carboxamide
Database identifiers
- CAS
6332-97-4- PubChem CID
- 236353
- DTXSID
DTXSID40284741
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 95.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 298
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Compound notes
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