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CAS No.: | 28232-66-8 |
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Name: | 3-Bromo-5-(4-chlorophenoxy)pyridine |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C11H7BrClNO |
Molecular Weight: | 284.54 |
Synonyms: | Pyridine,3-bromo-5-(p-chlorophenoxy)- (8CI);3-Bromo-5-(4-chlorophenoxy)pyridine; |
Density: | 1.569 g/cm3 |
Melting Point: | 79 °C |
Boiling Point: | 341.402 °C at 760 mmHg |
Flash Point: | 160.274 °C |
PSA: | 22.12000 |
LogP: | 4.28980 |
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The 3-Bromo-5-(4-chlorophenoxy)pyridine with the CAS number 28232-66-8 is also called Pyridine,3-bromo-5-(4-chlorophenoxy)-. Its molecular formula is C11H7BrClNO. This chemical is a kind of organics. It should be stored in dry and cool environment.
The properties of the chemical are: (1)ACD/LogP: 4.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.294; (4)ACD/LogD (pH 7.4): 4.294; (5)ACD/BCF (pH 5.5): 1080.749; (6)ACD/BCF (pH 7.4): 1080.936; (7)ACD/KOC (pH 5.5): 5165.571; (8)ACD/KOC (pH 7.4): 5166.464; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 22.12 Å2; (13)Index of Refraction: 1.616; (14)Molar Refractivity: 63.373 cm3; (15)Molar Volume: 181.38 cm3; (16)Polarizability: 25.123×10-24cm3; (17)Surface Tension: 48.603 dyne/cm; (18)Enthalpy of Vaporization: 56.19 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ccc1Oc2cc(cnc2)Br)Cl
(2)InChI: InChI=1/C11H7BrClNO/c12-8-5-11(7-14-6-8)15-10-3-1-9(13)2-4-10/h1-7H
(3)InChIKey: WBVDIRRTMMAHKU-UHFFFAOYAM