Basic information
- CAS
6342-84-3- Standard SMILES
CC(=O)Nc1cc(C(C)C)c([N+](=O)[O-])cc1C- InChIKey
BYDMLHYKFQMQJT-UHFFFAOYSA-N- Molecular formula
- C12H16N2O3
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.11609238
Names & identifiers
- Preferred name
- n-[2-Methyl-4-nitro-5-(propan-2-yl)phenyl]acetamide
- IUPAC
- N-(2-methyl-4-nitro-5-propan-2-ylphenyl)acetamide
- English name
- N-(2-methyl-4-nitro-5-propan-2-yl-phenyl)acetamide
- Molecular formula
- C12H16N2O3
- Molecular weight
- 236.27
Names & synonyms
6342-84-3n-[2-methyl-4-nitro-5-(propan-2-yl)phenyl]acetamideNSC46654DTXSID20286607Acetamide, N-[2-methyl-5-(1-methylethyl)-4-nitrophenyl]-NSC-46654DS-009498N-(2-methyl-4-nitro-5-propan-2-yl-phenyl)acetamide
Database identifiers
- CAS
6342-84-3- PubChem CID
- 240451
- DTXSID
DTXSID20286607
Properties
Computed structural properties
- XLogP
- 2.4
- 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
- 299
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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