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Name
5-BROMOTHIOPHENE-2-BORONIC ACID PINACOL ESTER
- EINECS
- CAS No. 676501-84-1
- Article Data6
- CAS DataBase
- Density 1.387 g/cm3
- Solubility
- Melting Point
- Formula C10H14BBrO2S
- Boiling Point 332.026 °C at 760 mmHg
- Molecular Weight 289.001
- Flash Point 154.604 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
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Molecular Structure
- Hazard Symbols
- Synonyms 5-BROMOTHIOPHENE-2-BORONIC ACID PINACOL ESTER;5-BroMo-2-thiopheneboronic acid pinacol ester;2-(5-Bromothiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- PSA 46.70000
- LogP 2.80980
5-Bromothiophene-2-boronic acid pinacol ester Specification
This chemical is called 1,3,2-Dioxaborolane,2-(5-bromo-2-thienyl)-4,4,5,5-tetramethyl-, and its systematic name is 2-(5-Bromothiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane. With the molecular formula of C10H14BBrO2S, its molecular weight is 289.00. The CAS registry number of the chemical is 676501-84-1.
Other characteristics of 1,3,2-Dioxaborolane,2-(5-bromo-2-thienyl)-4,4,5,5-tetramethyl- can be summarised as followings: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 46.7 Å2; (5)Index of Refraction: 1.54; (6)Molar Refractivity: 65.319 cm3; (7)Molar Volume: 208.311 cm3; (8)Polarizability: 25.895×10-24cm3; (9)Surface Tension: 38.174 dyne/cm; (10)Density: 1.387 g/cm3; (11)Flash Point: 154.604 °C; (12)Enthalpy of Vaporization: 55.195 kJ/mol; (13)Boiling Point: 332.026 °C at 760 mmHg; (14)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Brc2sc(B1OC(C)(C)C(O1)(C)C)cc2
2.InChI: InChI=1/C10H14BBrO2S/c1-9(2)10(3,4)14-11(13-9)7-5-6-8(12)15-7/h5-6H,1-4H3
3.InChIKey: QRTVEZRHUSSDCW-UHFFFAOYAK
4.Std. InChI: InChI=1S/C10H14BBrO2S/c1-9(2)10(3,4)14-11(13-9)7-5-6-8(12)15-7/h5-6H,1-4H3
5.Std. InChIKey: QRTVEZRHUSSDCW-UHFFFAOYSA-N
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