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| CAS No.: | 445-83-0 |
|---|---|
| Name: | 4-Fluoro-2-nitroanisole |
| Molecular Structure: | |
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|
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| Formula: | C7H6FNO3 |
| Molecular Weight: | 171.128 |
| Synonyms: | 4-FLUORO-1-METHOXY-2-NITROBENZENE;4-FLUORO-2-NITROANISOLE;4-Fluoro-2-nitro-methoxybenzene;4-Fluoro-2-nitroanisole 98%;4-Fluoro-2-nitroanisole98%;1-Methoxy-2-nitro-4-fluorobenzene;4-Fluoro-2-nitroanis |
| Density: | 1.321 g/cm3 |
| Melting Point: | 62-64 °C(lit.) |
| Boiling Point: | 272.4 °C at 760 mmHg |
| Flash Point: | 118.5 °C |
| Hazard Symbols: |
 Xi,  Xn
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 55.05000 |
| LogP: | 2.26570 |
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Specification
The 4-Fluoro-2-nitroanisole, with the CAS registry number 445-83-0, is also known as 4-Fluoro-2-nitroanisole 98%. It belongs to the product categories of Other Fluorin-Contained Compounds; Blocks; Fluoro Compounds; Nitro Compounds; Anisole; Anisoles, Alkyloxy Compounds & Phenylacetates; Fluorine Compounds; Nitro Compounds; Nitro Compounds; Nitrogen Compounds; Organic Building Blocks. This chemical's molecular formula is C7H6FNO3 and molecular weight is 171.13. Its systematic name is called 4-fluoro-1-methoxy-2-nitrobenzene.
Physical properties of 4-Fluoro-2-nitroanisole: (1)ACD/LogP: 1.76; (2)ACD/LogD (pH 5.5): 1.76; (3)ACD/LogD (pH 7.4): 1.76; (4)ACD/BCF (pH 5.5): 12.73; (5)ACD/BCF (pH 7.4): 12.73; (6)ACD/KOC (pH 5.5): 215; (7)ACD/KOC (pH 7.4): 215; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.521; (11)Molar Refractivity: 39.47 cm3; (12)Molar Volume: 129.4 cm3; (13)Surface Tension: 40.4 dyne/cm; (14)Density: 1.321 g/cm3; (15)Flash Point: 118.5 °C; (16)Enthalpy of Vaporization: 49.01 kJ/mol; (17)Boiling Point: 272.4 °C at 760 mmHg; (18)Vapour Pressure: 0.0102 mmHg at 25°C.
Uses of 4-Fluoro-2-nitroanisole: it can be used to produce 5-fluoro-2-methoxy-aniline. This reaction will need reagent Raney nickel.
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When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes and may cause damage to health. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cc(F)ccc1OC
(2)InChI: InChI=1/C7H6FNO3/c1-12-7-3-2-5(8)4-6(7)9(10)11/h2-4H,1H3
(3)InChIKey: FWLPYISRFBKEKV-UHFFFAOYAQ