Basic information
- CAS
70210-03-6- Standard SMILES
C[N+](C)(C)Cc1ccc(Nc2ccc(N)c3c2C(=O)c2ccccc2C3=O)cc1.[Cl-]- InChIKey
YWQGBEZVKSQFGW-UHFFFAOYSA-N- Molecular formula
- C24H24N3O2.Cl
- Average molar mass
- 421.9 g/mol
- Monoisotopic mass
- 421.1557047
Names & identifiers
- Preferred name
- Benzenemethanaminium, 4-[(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-N,N,N-trimethyl-, chloride (1:1)
- IUPAC
- [4-[(4-amino-9,10-dioxoanthracen-1-yl)amino]phenyl]methyl-trimethylazanium chloride
Names & synonyms
70210-03-6EINECS 274-400-0DTXSID80887538Benzenemethanaminium, 4-((4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino)-N,N,N-trimethyl-, chlorideBenzenemethanaminium, 4-((4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino)-N,N,N-trimethyl-, chloride (1:1)Benzenemethanaminium, 4-[(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-N,N,N-trimethyl-, chlorideBenzenemethanaminium, 4-[(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-N,N,N-trimethyl-, chloride (1:1)RefChem:117607DTXCID601026829{4-[(4-amino-9,10-dioxo-9,10-dihydroanthracen-1-yl)amino]phenyl}-n,n,n-trimethylmethanaminium chloride(p-((4-Amino-9,10-dihydro-9,10-dioxo-1-anthryl)amino)benzyl)trimethylammonium chlorideNS00063065
Database identifiers
- CAS
70210-03-6- PubChem CID
- 112385
- DTXSID
DTXSID80887538- EC Number
- 274-400-0
Properties
Computed structural properties
- Topological polar surface area
- 72.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 620
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Benzenemethanaminium, 4-[(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-N,N,N-trimethyl-, chloride
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenemethanaminium, 4-[(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)amino]-N,N,N-trimethyl-, chloride (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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