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Nitroiminodiethylenediisocyanic acid

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Name

Nitroiminodiethylenediisocyanic acid

EINECS N/A
CAS No. 7046-61-9 Density 1.34g/cm3
PSA 107.92000 LogP -0.32510
Solubility N/A Melting Point N/A
Formula C6H8N4O4 Boiling Point 380.5°C at 760 mmHg
Molecular Weight 200.18 Flash Point 183.9°C
Transport Information N/A Appearance N/A
Safety Poison by intravenous route. A sensitizer. When heated to decomposition it emits toxic fumes of NOx. Risk Codes N/A
Molecular Structure Molecular Structure of 7046-61-9 ((Nitroimino)diethylenediisocyanate) Hazard Symbols N/A
Synonyms

Isocyanic acid,(nitroimino)diethylene ester;3-Nitro-3-azapentane-1,5-diisocyanate;ISOCYANIC ACID,NITROIMINODIETHYLENEDI;3-Nitraza-1,5-pentan-diisocyanat;Ethanamine,2-isocyanato-N-(2-isocyanatoethyl)-N-nitro;Nitroiminodiethylenediisocyanic acid;

 

Nitroiminodiethylenediisocyanic acid Chemical Properties

Empirical Formula of Nitroiminodiethylenediisocyanic acid (CAS NO.7046-61-9): C6H8N4O4
Molecular Weight: 200.1521 
Index of Refraction: 1.55
Density: 1.34 g/cm3
Flash Point: 183.9 °C
Enthalpy of Vaporization: 62.86 kJ/mol
Boiling Point: 380.5 °C at 760 mmHg
Vapour Pressure: 5.43E-06 mmHg at 25 °C
Structure of Nitroiminodiethylenediisocyanic acid (CAS NO.7046-61-9):
                          
IUPAC Name: N,N-Bis(2-isocyanatoethyl)nitramide
Canonical SMILES: C(CN(CCN=C=O)[N+](=O)[O-])N=C=O
InChI: InChI=1S/C6H8N4O4/c11-5-7-1-3-9(10(13)14)4-2-8-6-12/h1-4H2
InChIKey: PMZAXZNFRDOMGE-UHFFFAOYSA-N

Nitroiminodiethylenediisocyanic acid Toxicity Data With Reference

1.    

ivn-mus LD50:56 mg/kg

    CSLNX*    U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) NX#05191 .

Nitroiminodiethylenediisocyanic acid Consensus Reports

Reported in EPA TSCA Inventory.

Nitroiminodiethylenediisocyanic acid Safety Profile

Poison by intravenous route. A sensitizer. When heated to decomposition Nitroiminodiethylenediisocyanic acid (CAS NO.7046-61-9) emits toxic fumes of NOx.

Nitroiminodiethylenediisocyanic acid Standards and Recommendations

NIOSH REL: (Diisocyanates) TWA 0.005 ppm; CL 0.02 ppm/10M

Nitroiminodiethylenediisocyanic acid Specification

 Nitroiminodiethylenediisocyanic acid , its cas register number is 7046-61-9. It also can be called Isocyanic acid, (nitroimino)diethylene ester ; Ethanamine, 2-isocyanato-N-(2-isocyanatoethyl)-N-nitro- ; and 3-Nitro-3-azapentane-1,5-diisocyanate .

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