AC1Q3QHM
2-[4-[(2,6-dichloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethyl-trimethylazanium;methyl sulfate
Also Known As: Ethyl-phenothiazin-2-carbamat|(2-((4-((2,6-Dichloro-4-nitrophenyl)azo)phenyl)ethylamino)ethyl)trimethylammonium methyl sulphate|[2-[[4-[ azo]phenyl]ethylamino]ethyl]trimethylammoniummethylsulphate|2-((N-(4-(2,6-Dichloro-4-nitrophenyl)azo)phenyl)-N-ethyl)amino)-N,N,N-trimethylethanaminium, methyl sulfate|2-[[4-(2,6-dichloro-4-nitro-phenyl)diazenylphenyl]-ethyl-amino]ethyl-trimethyl-azanium; sulfonatooxymethane|2-[{4-[(e)-(2,6-dichloro-4-nitrophenyl)diazenyl]phenyl}(ethyl)amino]-n,n,n-trimethylethanaminium methyl sulfate|Ethanaminium, 2-((4-((2,6-dichloro-4-nitrophenyl)azo)phenyl)ethylamino)-N,N,N-trimethyl-, methyl sulfate|Ethanaminium, 2-((4-(2-(2,6-dichloro-4-nitrophenyl)diazenyl)phenyl)ethylamino)-N,N,N-trimethyl-, methyl sulfate (1:1)|Ethanaminium, 2-[[4-[(2,6-dichloro-4-nitrophenyl)azo]phenyl]ethylamino]-N,N,N-trimethyl-, methyl sulfate|[2-[[4-[(2,6-dichloro-4-nitrophenyl)azo]phenyl]ethylamino]ethyl]trimethylammonium methyl sulfate|[2-[[4-[(2,6-dichloro-4-nitrophenyl)azo]phenyl]ethylamino]ethyl]trimethylammonium methyl sulphate|2-[{4-[(2,6-Dichloro-4-nitrophenyl)diazenyl]phenyl}(ethyl)amino]-N,N,N-trimethylethan-1-aminium methyl sulfate|2-[4-[(2,6-dichloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethyl-trimethylazanium; methyl sulfate|Ethanaminium, 2-[[4-[2-(2,6-dichloro-4-nitrophenyl)diazenyl]phenyl]ethylamino]-N,N,N-trimethyl-, methyl sulfate (1:1)
| Molecular Formula | C20H27Cl2N5O6S |
|---|---|
| Molecular Weight | 535.1059 g/mol |
| LogP | 4.9425 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 535.1059 |
| Monoisotopic Mass | 535.1059 |
| Heavy Atoms | 34 |
| Complexity | 608.0 |
Chemical Identifiers
| CAS Number | 4379-76-4 |
|---|---|
| SMILES | CCN(CC[N+](C)(C)C)C1=CC=C(C=C1)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl.COS(=O)(=O)[O-] |
| InChIKey | OMAWCUOTEHMCOL-UHFFFAOYSA-M |
Product Overview
AC1Q3QHM (CAS 4379-76-4), with molecular formula C20H27Cl2N5O6S and molecular weight 535.1059 g/mol. IUPAC: 2-[4-[(2,6-dichloro-4-nitrophenyl)diazenyl]-N-ethylanilino]ethyl-trimethylazanium;methyl sulfate.
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