Basic information
- Standard SMILES
COc1cc(CO)c(O)c(N=Nc2ccc(OC)cc2[N+](=O)[O-])c1- InChIKey
XCGLNSDUUKKIIB-UHFFFAOYSA-N- Molecular formula
- C15H15N3O6
- Average molar mass
- 333.3 g/mol
Names & identifiers
- Preferred name
- 2-(Hydroxymethyl)-4-methoxy-6-((4-methoxy-2-nitrophenyl)diazenyl)phenol
- IUPAC
- 2-(hydroxymethyl)-4-methoxy-6-[(4-methoxy-2-nitrophenyl)diazenyl]phenol
Names & synonyms
SCHEMBL1099792SCHEMBL1099794XCGLNSDUUKKIIB-UHFFFAOYSA-N2-(hydroxymethyl)-4-methoxy-6-((4-methoxy-2-nitrophenyl)diazenyl)phenol
Database identifiers
- PubChem CID
- 136348293
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 129 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 443
Related reactions
2 records
Linked notes
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