n-(4-Tert-butyl-3-nitrophenyl)acetamide
Basic information
- CAS
31951-11-8- Standard SMILES
CC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1- InChIKey
UWZJMCNFDLBYDY-UHFFFAOYSA-N- Molecular formula
- C12H16N2O3
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.11609238
Names & identifiers
- Preferred name
- n-(4-Tert-butyl-3-nitrophenyl)acetamide
- IUPAC
- N-(4-tert-butyl-3-nitrophenyl)acetamide
- English name
- N-(3-nitro-4-tert-butyl-phenyl)acetamide
- Molecular formula
- C12H16N2O3
- Molecular weight
- 236.27
Names & synonyms
n-(4-tert-butyl-3-nitrophenyl)acetamide31951-11-8N-(3-NITRO-4-TERT-BUTYL-PHENYL)ACETAMIDEN-{4-tert-butyl-3-nitrophenyl}acetamideNSC43048Oprea1_869652SCHEMBL3456598DTXSID50285865NSC-43048AE-562/12222725Acetamide, N-[4-(1,1-dimethylethyl)-3-nitrophenyl]-
Database identifiers
- CAS
31951-11-8- PubChem CID
- 238593
- DTXSID
DTXSID50285865
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 304
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Compound notes
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