Basic information
- Standard SMILES
COc1cccc([N+](=O)[O-])c1CCO- InChIKey
FFUMLKIKYJJQAT-UHFFFAOYSA-N- Molecular formula
- C9H11NO4
- Average molar mass
- 197.19 g/mol
- Monoisotopic mass
- 197.06880783
Names & identifiers
- Preferred name
- 2-(2-Methoxy-6-nitrophenyl)-1-ethanol
- IUPAC
- 2-(2-methoxy-6-nitrophenyl)ethanol
Names & synonyms
2-(2-methoxy-6-nitrophenyl)-1-ethanolSCHEMBL942459FFUMLKIKYJJQAT-UHFFFAOYSA-N2-(2-methoxy-6-nitro-phenyl)ethanol2-(2-methoxy-6-nitro-phenyl)-ethanol
Database identifiers
- PubChem CID
- 22720365
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 192
Related reactions
4 records
Compound notes
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