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108306-64-5

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Basic Information
CAS No.: 108306-64-5
Name: 5-Bromo-2-iodothiazole
Article Data: 3
Molecular Structure:
Molecular Structure of 108306-64-5 (5-Bromo-2-iodothiazole)
Formula: C3HBrINS
Molecular Weight: 289.922
Synonyms: 5-BROMO-2-IODOTHIAZOLE
Density: 2.626 g/cm3
Boiling Point: 299.242 °C at 760 mmHg
Flash Point: 134.777 °C
PSA: 41.13000
LogP: 2.51020
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Specification

This chemical is called 5-Bromo-2-iodothiazole, and it can also be named as thiazole, 5-bromo-2-iodo-. With the molecular formula of C3HBrINS, its molecular weight is 289.92. The CAS registry number of this chemical is 108306-64-5.

Other characteristics of the 5-Bromo-2-iodothiazole can be summarised as followings: (1)ACD/LogP: 2.80; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.798; (4)ACD/LogD (pH 7.4): 2.798; (5)ACD/BCF (pH 5.5): 78.852; (6)ACD/BCF (pH 7.4): 78.852; (7)ACD/KOC (pH 5.5): 793.143; (8)ACD/KOC (pH 7.4): 793.143; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 41.13 Å2; (13)Index of Refraction: 1.714; (14)Molar Refractivity: 43.325 cm3; (15)Molar Volume: 110.394 cm3; (16)Polarizability: 17.176×10-24cm3; (17)Surface Tension: 62.734 dyne/cm; (18)Density: 2.626 g/cm3; (19)Flash Point: 134.777 °C; (20)Enthalpy of Vaporization: 51.765 kJ/mol; (21)Boiling Point: 299.242 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: c1c(sc(n1)I)Br
2.InChI: InChI=1/C3HBrINS/c4-2-1-6-3(5)7-2/h1H
3.InChIKey: KYEQBVRCNVCFOF-UHFFFAOYAI