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| Name |
4,4′-Biphenylenebis(2-oxoethylene) bis(dimethyl(2-hydroxyethyl)-ammonium) dibromide |
EINECS | N/A |
| CAS No. | 73-51-8 | Density | N/A |
| PSA | 74.60000 | LogP | -1.13960 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C24H34N2O4•2Br | Boiling Point | N/A |
| Molecular Weight | 574.42 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | Deadly poison by intraperitoneal and intravenous routes. See also BROMIDES. When heated to decomposition it emits very toxic fumes of NOx, NH3, and Br−. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
4,4′-Biphenylenebis(2-oxoethylene) bis(dimethyl(2-hydroxyethyl)-ammonium) dibromide Chemical Properties
Molecular Structure of 4,4′-Biphenylenebis(2-oxoethylene) bis(dimethyl(2-hydroxyethyl)-ammonium) dibromide (CAS NO. 73-51-8):
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IUPAC Name: 2-hydroxyethyl-[2-[4-[4-[2-[2-hydroxyethyl(dimethyl)azaniumyl]-2-oxoethyl]phenyl]phenyl]acetyl]-dimethylazanium dibromide
Empirical Formula: C24H34Br2N2O4
Molecular Weight: 574.3458
H bond acceptors: 6
H bond donors: 2
Freely Rotating Bonds: 13
Polar Surface Area: 52.6 Å2
InChI
InChI=1/C24H34N2O4.2BrH/c1-25(2,13-15-27)23(29)17-19-5-9-21(10-6-19)22-11-7-20(8-12-22)18-24(30)26(3,4)14-16-28;;/h5-12,27-28H,13-18H2,1-4H3;2*1H/q+2;;/p-2
Smiles
c1(c2ccc(CC([N+](CCO)(C)C)=O)cc2)ccc(CC([N+](CCO)(C)C)=O)cc1.[BrH-].[BrH-]
Classification Code: Drug / Therapeutic Agent
4,4′-Biphenylenebis(2-oxoethylene) bis(dimethyl(2-hydroxyethyl)-ammonium) dibromide Toxicity Data With Reference
| 1. | ipr-rat LD50:45 µg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 115 (1955),127. | ||
| 2. | ipr-mus LD50:20 µg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 115 (1955),127. | ||
| 3. | ivn-dog LDLo:75 µg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 115 (1955),127. | ||
| 4. | ivn-rbt LDLo:50 µg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 115 (1955),127. | ||
| 5. | ipr-gpg LDLo:30 µg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 115 (1955),127. |
4,4′-Biphenylenebis(2-oxoethylene) bis(dimethyl(2-hydroxyethyl)-ammonium) dibromide Consensus Reports
4,4′-Biphenylenebis(2-oxoethylene) bis(dimethyl(2-hydroxyethyl)-ammonium) dibromide (CAS NO. 73-51-8) was reported in JPETAB Journal of Pharmacology and Experimental Therapeutics.
4,4′-Biphenylenebis(2-oxoethylene) bis(dimethyl(2-hydroxyethyl)-ammonium) dibromide Safety Profile
Deadly poison by intraperitoneal and intravenous routes. See also BROMIDES. When heated to decomposition it emits very toxic fumes of NOx, NH3, and Br−.
4,4′-Biphenylenebis(2-oxoethylene) bis(dimethyl(2-hydroxyethyl)-ammonium) dibromide Specification
4,4′-Biphenylenebis(2-oxoethylene) bis(dimethyl(2-hydroxyethyl)-ammonium) dibromide , with CAS number of 73-51-8, can be called Ammonium, 4,4'-biphenylenebis(2-oxoethylene)bis(dimethyl(2-hydroxyethyl)-, dibromide .
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