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| CAS No.: | 350-46-9 |
|---|---|
| Name: | 4-Fluoronitrobenzene |
| Molecular Structure: | |
|
|
|
| Formula: | C6H4FNO2 |
| Molecular Weight: | 141.102 |
| Synonyms: | 1-Fluoro-4-nitrobenzene;1-Nitro-4-fluorobenzene;4-Fluoro-1-nitrobenzene;4-Nitro-1-fluorobenzene;4-Nitrofluorobenzene;4-Nitrophenyl fluoride;Benzene,1-fluoro-4-nitro-;Para-fluoronitrobenzene;p-Fluoronitrobenzene;p-Nitrofluorobenzene; |
| EINECS: | 206-502-8 |
| Density: | 1.337 g/cm3 |
| Melting Point: | 21 °C |
| Boiling Point: | 206.5 °C at 760 mmHg |
| Flash Point: | 83.3 °C |
| Solubility: | Insoluble in water. |
| Appearance: | clear to yellow liquid |
| Hazard Symbols: |
 Xn
|
| Risk Codes: | 20/21/22 |
| Safety: | 36/37 |
| PSA: | 45.82000 |
| LogP: | 2.25710 |
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Chemistry
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IUPAC Name: 1-Fluoro-4-nitrobenzene
Molecular Formula: C6H4FNO2
Molecular Weight: 141.10 g/mol
Canonical SMILES: C1=CC(=CC=C1[N+](=O)[O-])F
InChI: InChI=1S/C6H4FNO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H
EINECS: 206-502-8
Classification Code: Agricultural Chemical; Experimental pesticide; Mutation data; Unspecified / Unclassified pesticide
Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
Index of Refraction: 1.534
Molar Refractivity: 32.79 cm3
Molar Volume: 105.4 cm3
Surface Tension: 42.8 dyne/cm
Density: 1.337 g/cm3
Flash Point: 83.3 °C
Enthalpy of Vaporization: 42.47 kJ/mol
Boiling Point: 206.5 °C at 760 mmHg
Melting Point: 21 °C(lit.)
Vapour Pressure of 4-Fluoronitrobenzene (CAS NO.350-46-9): 0.34 mmHg at 25 °C
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rat | LC50 | inhalation | 2600mg/m3/4H (2600mg/m3) | GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS | National Technical Information Service. Vol. OTS0571745, |
| rat | LDLo | oral | 250mg/kg (250mg/kg) | National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 19, 1953. |
Safety Profile
Poison by ingestion. Mutation data reported. When heated to decomposition it emits very toxic fumes of F− and NOx.
Hazard Codes: 
Xn,
T,
Xi
Risk Statements: 20/21/22-33
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
R33:Danger of cumulative effects.
Safety Statements: 36-36/37
S36:Wear suitable protective clothing.
S36/37:Wear suitable protective clothing and gloves.
RIDADR: UN 2811 6.1/PG 3
WGK Germany: 1
RTECS: DA1400000
Hazard Note: Toxic/Irritant
HazardClass: 6.1
PackingGroup of 4-Fluoronitrobenzene (CAS NO.350-46-9): III
Specification
4-Fluoronitrobenzene (CAS NO.350-46-9), its Synonyms are 1-Fluoro-4-nitrobenzene ; 1-Nitro-4-fluorobenzene ; 4-Fluoro-1-nitrobenzene ; 4-Nitrofluorobenzene ; Benzene, 1-fluoro-4-nitro- ; p-Fluoronitrobenzene ; p-Nitrofluorobenzene . It is yellow liquid.