Molecular Structure of Fluorotrinitromethane (CAS NO.1840-42-2):
IUPAC: Fluoro(trinitro)methane
Molecular Formula: CFN3O6
Molecular Weight: 169.0256
Density: 1.901 g/cm3
Flash Point: 16.3oC
Boiling Point: 103.4oC at 760 mmHg
Index of Refraction: 1.471
Molar Volume: 88.8 cm3
Surface Tension: 64.8 dyne/cm
Enthalpy of Vaporization: 34.25 kJ/mol
Vapour Pressure: 32.3 mmHg at 25oC
SMILES: O=[N+]([O-])C(F)([N+](=O)[O-])[N+]([O-])=O
InChI: InChI=1/CFN3O6/c2-1(3(6)7,4(8)9)5(10)11
InChIKey: IHOVZLJULZIGOW-UHFFFAOYAU
1. | ipr-mus LD50:57,300 µg/kg | KHFZAN Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. 10 (6)(1976),53. |
Reported in EPA TSCA Inventory.
Poison by intraperitoneal route. Mixtures with nitrobenzene are liquid explosives. When heated to decomposition it emits very toxic fumes of F− and NOx. See also FLUORIDES and NITRO COMPOUNDS.
Fluorotrinitromethane with cas registry number of 1840-42-2 is also known as Fluorotrinitromethane ; Methane, fluorotrinitro- ; Fluoronitroform . It would emit very toxic fumes when heated to decomposition. Fluorotrinitromethane with cas registry number of 1840-42-2 is used as a pharmaceutical intermediate .
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