Basic information
- CAS
101952-42-5- Standard SMILES
CC[n+]1c2cc(N)ccc2cc2ccc(N)cc21.O=S(=O)([O-])O- InChIKey
UAQBIKWAFBIWRS-UHFFFAOYSA-N- Molecular formula
- C15H17N3O4S
- Average molar mass
- 335.4 g/mol
- Monoisotopic mass
- 335.09397721
Names & identifiers
- Preferred name
- Acridinium, 3,6-diamino-10-ethyl-, sulfate
- IUPAC
- 10-ethylacridin-10-ium-3,6-diamine;hydrogen sulfate
Names & synonyms
ACRIDINIUM, 3,6-DIAMINO-10-ETHYL-, SULFATE101952-42-53,6-Diamino-10-ethylacridinium sulfateDTXSID701444003,6-Diamino-10-ethylacridin-10-ium hydrogen sulfate
Database identifiers
- CAS
101952-42-5- PubChem CID
- 59162
- DTXSID
DTXSID70144400
Properties
Computed structural properties
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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