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8-Bromo-3-iodo-quinoline

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Name

8-Bromo-3-iodo-quinoline

EINECS N/A
CAS No. 917251-85-5 Density 2.154 g/cm3
PSA 12.89000 LogP 3.60190
Solubility N/A Melting Point N/A
Formula C9H5BrIN Boiling Point 375.486 °C at 760 mmHg
Molecular Weight 333.95 Flash Point 180.887 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 917251-85-5 (8-Bromo-3-iodoquinoline) Hazard Symbols N/A
Synonyms

8-Bromo-3-iodoquinoline;Quinoline, 8-broMo-3-iodo-

 

8-Bromo-3-iodo-quinoline Specification

This chemical is called 8-Bromo-3-iodo-quinoline, and it can also be named as quinoline, 8-bromo-3-iodo-. With the molecular formula of C9H5BrIN, its molecular weight is 333.95. The CAS registry number of this chemical is 917251-85-5.

Other characteristics of the 8-Bromo-3-iodo-quinoline can be summarised as followings: (1)ACD/LogP: 3.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.451; (4)ACD/LogD (pH 7.4): 3.451; (5)ACD/BCF (pH 5.5): 247.121; (6)ACD/BCF (pH 7.4): 247.122; (7)ACD/KOC (pH 5.5): 1796.596; (8)ACD/KOC (pH 7.4): 1796.605; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å2; (13)Index of Refraction: 1.744; (14)Molar Refractivity: 62.784 cm3; (15)Molar Volume: 155.031 cm3; (16)Polarizability: 24.889×10-24cm3; (17)Surface Tension: 59.936 dyne/cm; (18)Density: 2.154 g/cm3; (19)Flash Point: 180.887 °C; (20)Enthalpy of Vaporization: 59.857 kJ/mol; (21)Boiling Point: 375.486 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: c1cc2cc(cnc2c(c1)Br)I
2.InChI: InChI=1/C9H5BrIN/c10-8-3-1-2-6-4-7(11)5-12-9(6)8/h1-5H
3.InChIKey: JPJKDNAXYHDTSK-UHFFFAOYAQ

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