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CAS No.: | 695-37-4 |
---|---|
Name: | 3-FLUOROPYRIDINE N-OXIDE |
Article Data: | 24 |
Molecular Structure: | |
Formula: | C5H4FNO |
Molecular Weight: | 113.091 |
Synonyms: | 3-Fluoropyridine1-oxide;3-Fluoropyridine N-oxide; |
EINECS: | 1533716-785-6 |
Density: | 1.18 g/cm3 |
Melting Point: | 65-68 °C |
Boiling Point: | 274.7 °C at 760 mmHg |
Flash Point: | 119.9 °C |
Solubility: | Slightly soluble in water. |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 25.46000 |
LogP: | 1.25420 |
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The CAS register number of 3-Fluoropyridine1-oxide is 695-37-4. It also can be called as 3-Fluoropyridine 1-oxide and the IUPAC name about this chemical is 3-fluoro-1-oxidopyridin-1-ium. The molecular formula about this chemical is C5H4FNO and the molecular weight is 113.09. It belongs to the following product categories which include Fluorin-contained pyridine series; Pyridine; Pyridines and so on.
Physical properties about 3-Fluoropyridine1-oxide are: (1)ACD/LogP: -1.15; (2)ACD/LogD (pH 5.5): -1.15; (3)ACD/LogD (pH 7.4): -1.15; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.64; (7)ACD/KOC (pH 7.4): 5.64; (8)#H bond acceptors: 2; (9)Polar Surface Area: 24.11Å2; (10)Index of Refraction: 1.494; (11)Molar Refractivity: 27.71 cm3; (12)Molar Volume: 95.1 cm3; (13)Polarizability: 10.98x10-24cm3; (14)Surface Tension: 35.7 dyne/cm; (15)Enthalpy of Vaporization: 49.25 kJ/mol; (16)Boiling Point: 274.7 °C at 760 mmHg; (17)Vapour Pressure: 0.00892 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][n+]1cccc(F)c1
(2)InChI: InChI=1/C5H4FNO/c6-5-2-1-3-7(8)4-5/h1-4H
(3)InChIKey: QVGBDRDOWKIYHK-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C5H4FNO/c6-5-2-1-3-7(8)4-5/h1-4H
(5)Std. InChIKey: QVGBDRDOWKIYHK-UHFFFAOYSA-N