Basic information
- Standard SMILES
CC(N)c1ccc([N+](=O)[O-])cc1- InChIKey
RAEVOBPXEHVUFY-UHFFFAOYSA-N- Molecular formula
- C8H10N2O2
- Average molar mass
- 166.18 g/mol
Names & identifiers
- Preferred name
- 1-(4-Nitrophenyl)ethanamine
- IUPAC
- 1-(4-nitrophenyl)ethanamine
Names & synonyms
1-(4-Nitrophenyl)ethanamine42142-15-41-(4-nitrophenyl)ethan-1-amineMFCD09041905(1S)-1-(4-nitrophenyl)ethanamineBenzenemethanamine, alpha-methyl-4-nitro-, (alphaS)-1-(4-NITROPHENYL)-ETHANAMINER-(+)-alpha-Methyl-4-nitrobenzylamine1,4-nitrophenylethylamineBenzenemethanamine, alpha-methyl-4-nitro-, (alphaR)-SCHEMBL8115221-(4'-nitrophenyl)ethylamine
Show more names
SCHEMBL46083531-(4-nitro-phenyl)-ethylamineSCHEMBL20377072alpha-methyl-para-nitrobenzylamineRAEVOBPXEHVUFY-UHFFFAOYSA-N(-)-p-nitro-alpha-methylbenzylamine(RS)-4-Nitro-alpha-methylbenzylamineAKOS000124130
Database identifiers
- PubChem CID
- 591995
- Nikkaji
- J647.344J
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 159
Related reactions
8 records
Compound notes
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