Basic information
- Standard SMILES
CNCc1ccc([N+](=O)[O-])cc1- InChIKey
JLKRJHPQNYVSGM-UHFFFAOYSA-N- Molecular formula
- C8H10N2O2
- Average molar mass
- 166.18 g/mol
Names & identifiers
- Preferred name
- N-methyl-1-(4-nitrophenyl)methanamine
- IUPAC
- N-methyl-1-(4-nitrophenyl)methanamine
Names & synonyms
N-methyl-1-(4-nitrophenyl)methanamine19499-60-6N-Methyl-4-nitrobenzylaminemethyl[(4-nitrophenyl)methyl]amineMFCD00666471Methyl-(4-nitro-benzyl)-aminebenzenemethanamine, N-methyl-4-nitro-methyl-4-nitrobenzylaminemethyl(4-nitrobenzyl)amine(4-nitrobenzyl)-methylamineN-methyl-N-p-nitrobenzylamine4-methylaminomethyl-nitrobenzene
Show more names
SCHEMBL1938300SCHEMBL6246420benzylamine, N-methyl-4-nitro-4-(methylaminomethyl)nitrobenzeneN-methyl-N-(4-nitrobenzyl)amine4-(methylaminomethyl) nitrobenzeneN-methyl(4-nitrophenyl)methanamineN-methyl-4-nitrobenzenemethanamine
Database identifiers
- PubChem CID
- 409440
- Nikkaji
- J1.998.909G
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 57.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 148
Related reactions
17 records
Compound notes
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