2-Methyl-n-[2-(2-nitrophenyl)ethyl]propan-1-amine
Basic information
- CAS
5339-22-0- Standard SMILES
CC(C)CNCCc1ccccc1[N+](=O)[O-]- InChIKey
SOYCMBJOWBKPLI-UHFFFAOYSA-N- Molecular formula
- C12H18N2O2
- Average molar mass
- 222.28 g/mol
- Monoisotopic mass
- 222.13682782
Names & identifiers
- Preferred name
- 2-Methyl-n-[2-(2-nitrophenyl)ethyl]propan-1-amine
- IUPAC
- 2-methyl-N-[2-(2-nitrophenyl)ethyl]propan-1-amine
Names & synonyms
5339-22-02-methyl-n-[2-(2-nitrophenyl)ethyl]propan-1-amineNSC3488DTXSID70968042NSC-3488AKOS011839044
Database identifiers
- CAS
5339-22-0- PubChem CID
- 220581
- DTXSID
DTXSID70968042
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 57.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 214
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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