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Thiazole-4-boronic acid pinacol ester

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Name

Thiazole-4-boronic acid pinacol ester

EINECS N/A
CAS No. 1083180-00-0 Density 1.121 g/cm3
PSA 59.59000 LogP 1.44230
Solubility N/A Melting Point N/A
Formula C9H14BNO2S Boiling Point 304.72 °C at 760 mmHg
Molecular Weight 211.093 Flash Point 138.09 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1083180-00-0 (thiazol-4-ylboronic acid pinacol ester) Hazard Symbols N/A
Synonyms

4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiazole;thiazole, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-;4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-thiazole;

 

Thiazole-4-boronic acid pinacol ester Specification

The CAS registry number of Thiazole-4-boronic acid pinacol ester is 1083180-00-0. The IUPAC name is 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiazole. In addition, the molecular formula is C9H14BNO2S and the molecular weight is 211.09. It should be stored in a cool and dry place.

Physical properties about Thiazole-4-boronic acid pinacol ester are: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 59.59 Å2; (5)Index of Refraction: 1.5; (6)Molar Refractivity: 55.397 cm3; (7)Molar Volume: 188.248 cm3; (8)Polarizability: 21.961 ×10-24cm3; (9)Surface Tension: 36.367 dyne/cm; (10)Density: 1.121 g/cm3; (11)Flash Point: 138.09 °C; (12)Enthalpy of Vaporization: 52.333 kJ/mol; (13)Boiling Point: 304.72 °C at 760 mmHg; (14)Vapour Pressure: 0.002 mmHg at 25°C; (15)Topological Polar Surface Area: 59.6 ; (16)Heavy Atom Count: 14.

You can still convert the following datas into molecular structure:
(1)SMILES: B1(OC(C(O1)(C)C)(C)C)c2cscn2
(2)InChI: InChI=1/C9H14BNO2S/c1-8(2)9(3,4)13-10(12-8)7-5-14-6-11-7/h5-6H,1-4H3
(3)InChIKey: IUHVEWBGPBCWTQ-UHFFFAOYAR

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