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CAS No.: | 57883-26-8 |
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Name: | 4-BROMO-2-ETHOXYPYRIDINE |
Molecular Structure: | |
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Formula: | C7H8BrNO |
Molecular Weight: | 202.051 |
Synonyms: | 2-Ethoxy-4-bromopyridine; |
Density: | 1.449 g/cm3 |
Boiling Point: | 221.2 °C at 760 mmHg |
Flash Point: | 87.6 °C |
Hazard Symbols: | Xn |
Risk Codes: | 22-37/38-41 |
Safety: | 26-39 |
PSA: | 22.12000 |
LogP: | 2.24280 |
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The cas register number of 4-Bromo-2-ethoxypyridine is 57883-26-8. It also can be called as Pyridine,4-bromo-2-ethoxy- and the Systematic name about this chemical is 4-bromo-2-ethoxypyridine.
Physical properties about 4-Bromo-2-ethoxypyridine are: (1)ACD/LogP: 2.79; (2)ACD/LogD (pH 5.5): 2.79; (3)ACD/LogD (pH 7.4): 2.79; (4)ACD/BCF (pH 5.5): 77.47; (5)ACD/BCF (pH 7.4): 77.54; (6)ACD/KOC (pH 5.5): 782.95; (7)ACD/KOC (pH 7.4): 783.66; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 22.12Å2; (11)Index of Refraction: 1.534; (12)Molar Refractivity: 43.34 cm3; (13)Molar Volume: 139.3 cm3; (14)Polarizability: 17.18x10-24cm3; (15)Surface Tension: 39 dyne/cm; (16)Enthalpy of Vaporization: 43.9 kJ/mol; (17)Boiling Point: 221.2 °C at 760 mmHg; (18)Vapour Pressure: 0.161 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccnc(OCC)c1
(2)InChI: InChI=1/C7H8BrNO/c1-2-10-7-5-6(8)3-4-9-7/h3-5H,2H2,1H3
(3)InChIKey: XHPRAYURZWKYAV-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C7H8BrNO/c1-2-10-7-5-6(8)3-4-9-7/h3-5H,2H2,1H3
(5)Std. InChIKey: XHPRAYURZWKYAV-UHFFFAOYSA-N