Basic information
- Standard SMILES
COc1cccc(OC)c1-c1ccc(CO)c([N+](=O)[O-])c1- InChIKey
CYUGEFOEUMGQMB-UHFFFAOYSA-N- Molecular formula
- C15H15NO5
- Average molar mass
- 289.28 g/mol
Names & identifiers
- Preferred name
- 4-(2',6'-Dimethoxyphenyl)-2-nitrobenzyl alcohol
- IUPAC
- [4-(2,6-dimethoxyphenyl)-2-nitrophenyl]methanol
Names & synonyms
SCHEMBL7325696CYUGEFOEUMGQMB-UHFFFAOYSA-N4-(2',6'-dimethoxyphenyl)-2-nitrobenzyl alcohol
Database identifiers
- PubChem CID
- 70056006
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 333
Related reactions
4 records
Compound notes
Loading…