Benzeneacetonitrile,2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- supplier

Name
(2-CYANOMETHYLPHENYL)BORONIC ACID, PINACOL ESTER
EINECS
CAS No. 325141-71-7
Article Data3
CAS DataBase
Density 1.05 g/cm³
Solubility Miscible with water.
Melting Point
Formula C₁₄H₁₈BNO₂
Boiling Point 379.1 °C at 760 mmHg
Molecular Weight 243.113
Flash Point 183.1 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 20/21/22-36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 2-(Cyanomethyl)benzeneboronic acid, pinacol ester 97%;
PSA 42.25000
LogP 2.05188

Benzeneacetonitrile,2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- Specification

The Benzeneacetonitrile,2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, with the CAS registry number 325141-71-7, is also known as 2-(Cyanomethyl)benzeneboronic acid, pinacol ester 97%. It belongs to the product categories of Blocks; Boronic Acids. This chemical's molecular formula is C₁₄H₁₈BNO₂ and molecular weight is 243.11. Its systematic name is called [2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetonitrile.

Physical properties of Benzeneacetonitrile,2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 2; (4)Index of Refraction: 1.505; (5)Molar Refractivity: 68.65 cm³; (6)Molar Volume: 231.2 cm³; (7)Surface Tension: 36.8 dyne/cm; (8)Density: 1.05 g/cm³; (9)Flash Point: 183.1 °C; (10)Enthalpy of Vaporization: 62.71 kJ/mol; (11)Boiling Point: 379.1 °C at 760 mmHg; (12)Vapour Pressure: 5.99E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: N#CCc2ccccc2B1OC(C)(C)C(O1)(C)C
(2)InChI: InChI=1/C14H18BNO2/c1-13(2)14(3,4)18-15(17-13)12-8-6-5-7-11(12)9-10-16/h5-8H,9H2,1-4H3
(3)InChIKey: FIARMBRSPSECPP-UHFFFAOYAS

Product Name

(2-CYANOMETHYLPHENYL)BORONIC ACID, PINACOL ESTER

Benzeneacetonitrile,2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- Specification

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