- Pyridinium, 1,1'-(oxydimethylene)bis(2-formyl-, dichloride, dioxime
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Cas Database |
| Name |
Pyridinium, 1,1'-(oxydimethylene)bis(2-formyl-, dichloride, dioxime |
EINECS | N/A |
| CAS No. | 34211-26-2 | Density | g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C14H16N4O3•2Cl | Boiling Point | 406.3°Cat760mmHg |
| Molecular Weight | 359.24 | Flash Point | 199.5°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits very toxic fumes of Cl− and NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
Article Data | 1 |
Pyridinium, 1,1'-(oxydimethylene)bis(2-formyl-, dichloride, dioxime Chemical Properties
Molecule structure of Pyridinium, 1,1'-(oxydimethylene)bis(2-formyl-, dichloride, dioxime (CAS NO.34211-26-2):
IUPAC Name: oxo-[(E)-[1-[[(2E)-2-(Oxoazaniumylmethylidene)pyridin-1-yl]methoxymethyl]pyridin-2-ylidene]methyl]azanium dichloride
Molecular Weight: 359.20784 g/mol
Molecular Formula: C14H16Cl2N4O3
Boiling Point: 406.3 °C at 760 mmHg
Flash Point: 199.5 °C
Enthalpy of Vaporization: 65.8 kJ/mol
Vapour Pressure: 8.24E-07 mmHg at 25 °C
H-Bond Donor: 2
H-Bond Acceptor: 7
Rotatable Bond Count: 6
Tautomer Count: 3
Exact Mass: 358.059946
MonoIsotopic Mass: 358.059946
Topological Polar Surface Area: 77.8
Heavy Atom Count: 23
Complexity: 523
Canonical SMILES: C1=CC(=C[NH+]=O)N(C=C1)COCN2C=CC=CC2=C[NH+]=O.[Cl-].[Cl-]
Isomeric SMILES: C1=C/C(=C\[NH+]=O)/N(C=C1)COCN2/C(=C/[NH+]=O)/C=CC=C2.[Cl-].[Cl-]
InChI: InChI=1S/C14H14N4O3.2ClH/c19-15-9-13-5-1-3-7-17(13)11-21-12-18-8-4-2-6-14(18)10-16-20;;/h1-10H,11-12H2;2*1H/b13-9+,14-10+;;
InChIKey of Pyridinium, 1,1'-(oxydimethylene)bis(2-formyl-, dichloride, dioxime (CAS NO.34211-26-2): XWUNTKOIXXFVMD-NJUUEJHISA-N
Pyridinium, 1,1'-(oxydimethylene)bis(2-formyl-, dichloride, dioxime Toxicity Data With Reference
| 1. | ipr-rat LD50:168 mg/kg | ARTODN Archives of Toxicology. 41 (1979),301. | ||
| 2. | ivn-rat LD50:67 mg/kg | ARTODN Archives of Toxicology. 41 (1979),301. |
Pyridinium, 1,1'-(oxydimethylene)bis(2-formyl-, dichloride, dioxime Safety Profile
Poison by intraperitoneal and intravenous routes. When heated to decomposition it emits very toxic fumes of Cl− and NOx.
Pyridinium, 1,1'-(oxydimethylene)bis(2-formyl-, dichloride, dioxime Specification
Pyridinium, 1,1'-(oxydimethylene)bis(2-formyl-, dichloride, dioxime (CAS NO.34211-26-2) is also named as Bis((hydroxyimino-methyl)-pyridinium-(1)-methyl)-aether- dichlorid ; Bis((hydroxyimino-methyl)-pyridinium-(1)-methyl)-aether-
dichlorid [German] ; Bis(2-hydroxyiminomethylpyridinium-1-methyl)ether dichloride ; HS 4 ; Pyridinium, 1,1'-(oxybis(methylene))bis(2-((hydroxyimino)methyl)-, dichloride (9CI) .
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