2-Hydroxyethyl-(1-nitroacridin-9-yl)azanium;chloride
Basic information
- CAS
77280-93-4- Standard SMILES
O=[N+]([O-])c1cccc2nc3ccccc3c([NH2+]CCO)c12.[Cl-]- InChIKey
WGUCIXFYKBZJBZ-UHFFFAOYSA-N- Molecular formula
- C15H14ClN3O3
- Average molar mass
- 319.74 g/mol
- Monoisotopic mass
- 319.072369
Overview
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Names & identifiers
- Preferred name
- 2-Hydroxyethyl-(1-nitroacridin-9-yl)azanium;chloride
- IUPAC
- 2-hydroxyethyl-(1-nitroacridin-9-yl)azanium chloride
Names & synonyms
2-hydroxyethyl-(1-nitroacridin-9-yl)azanium;chloride
Database identifiers
- CAS
77280-93-4- PubChem CID
- 53638
Properties
Computed structural properties
- Topological polar surface area
- 95.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 374
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Compound notes
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