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3034-54-6

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Basic Information
CAS No.: 3034-54-6
Name: 2-IODOTHIAZOLE
Article Data: 9
Molecular Structure:
Molecular Structure of 3034-54-6 (2-IODOTHIAZOLE)
Formula: C3H2INS
Molecular Weight: 211.026
Synonyms: 2-Iodothiazole;
Density: 2.239 g/cm3
Boiling Point: 232.5 °C at 760 mmHg
Flash Point: 94.4 °C
PSA: 41.13000
LogP: 1.74770
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Specification

The Thiazole, 2-iodo- is an organic compound with the formula C3H2INS. The systematic name of this chemical is 2-Iodo-1,3-thiazole. With the CAS registry number 3034-54-6, it is also named as 2-Iodothiazole. The product's categories are Sulphur Derivatives; Thiazoles. Besides, its molecular weight is 211.02.

Physical properties about Thiazole, 2-iodo- are: (1)ACD/LogP: 2.42; (2)ACD/LogD (pH 5.5): 2.42; (3)ACD/LogD (pH 7.4): 2.42; (4)ACD/BCF (pH 5.5): 40.55; (5)ACD/BCF (pH 7.4): 40.55; (6)ACD/KOC (pH 5.5): 492.7; (7)ACD/KOC (pH 7.4): 492.71; (8)#H bond acceptors: 1; (9)Polar Surface Area: 41.13 Å2; (10)Index of Refraction: 1.68; (11)Molar Refractivity: 35.63 cm3; (12)Molar Volume: 94.2 cm3; (13)Polarizability: 14.12×10-24 cm3; (14)Surface Tension: 58.1 dyne/cm; (15)Density: 2.239 g/cm3; (16)Flash Point: 94.4 °C; (17)Enthalpy of Vaporization: 45.01 kJ/mol; (18)Boiling Point: 232.5 °C at 760 mmHg; (19)Vapour Pressure: 0.0896 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C3H2INS/c4-3-5-1-2-6-3/h1-2H
(2)InChIKey: VAQSRTGFMKWNIH-UHFFFAOYAX
(3)Std. InChI: InChI=1S/C3H2INS/c4-3-5-1-2-6-3/h1-2H
(4)Std. InChIKey: VAQSRTGFMKWNIH-UHFFFAOYSA-N