Basic information
- CAS
75775-68-7- Standard SMILES
COc1cccc([NH2+]c2c3ccccc3nc3ccccc23)c1.CS(=O)(=O)[O-]- InChIKey
CSYJRSQWKSPLSL-UHFFFAOYSA-N- Molecular formula
- C21H20N2O4S
- Average molar mass
- 396.5 g/mol
- Monoisotopic mass
- 396.1143783
Names & identifiers
- Preferred name
- Acridine, 9-(m-anisidino)-, methanesulfonate
- IUPAC
- acridin-9-yl-(3-methoxyphenyl)azanium;methanesulfonate
Names & synonyms
ACRIDINE, 9-(m-ANISIDINO)-, METHANESULFONATE75775-68-7RefChem:10760589-(m-Anisidino)acridine methanesulfonate
Database identifiers
- CAS
75775-68-7- PubChem CID
- 53316
Properties
Computed structural properties
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 445
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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