Product Name

  • Name

    4-METHOXYPHENYLBORONIC ACID, PINACOL ESTER

  • EINECS
  • CAS No. 171364-79-7
  • Article Data254
  • CAS DataBase
  • Density 1.02 g/cm3
  • Solubility
  • Melting Point 26-28 °C
  • Formula C13H19BO3
  • Boiling Point 321.1 °C at 760 mmHg
  • Molecular Weight 234.103
  • Flash Point 148 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 171364-79-7 (4-METHOXYPHENYLBORONIC ACID, PINACOL ESTER)
  • Hazard Symbols
  • Synonyms 2-(4-Methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;4,4,5,5-Tetramethyl-2-(4-methoxyphenyl)-1,3,2-dioxaborolane;4-Methoxyphenylboronic acid pinacol ester;p-(Pinacolboryl)anisole;4-Methoxybenzeneboronic acid, pinacol ester;
  • PSA 27.69000
  • LogP 1.99440

4-Methoxyphenylboronic acid pinacol ester Specification

The 1,3,2-Dioxaborolane,2-(4-methoxyphenyl)-4,4,5,5-tetramethyl-, with the CAS registry number 171364-79-7, is also known as 4-Methoxyphenylboronic acid pinacol ester. This chemical's molecular formula is C13H19BO3 and molecular weight is 234.1. What's more, its systematic name is 2-(4-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane. 

Physical properties of 1,3,2-Dioxaborolane,2-(4-methoxyphenyl)-4,4,5,5-tetramethyl- are: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 27.69 Å2; (5)Index of Refraction: 1.49; (6)Molar Refractivity: 65.82 cm3; (7)Molar Volume: 227.3 cm3; (8)Polarizability: 26.09×10-24cm3; (9)Surface Tension: 31.9 dyne/cm; (10)Density: 1.02 g/cm3; (11)Flash Point: 148 °C; (12)Enthalpy of Vaporization: 54.05 kJ/mol; (13)Boiling Point: 321.1 °C at 760 mmHg; (14)Vapour Pressure: 0.000571 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O1B(OC(C)(C)C1(C)C)c2ccc(OC)cc2
(2)InChI: InChI=1S/C13H19BO3/c1-12(2)13(3,4)17-14(16-12)10-6-8-11(15-5)9-7-10/h6-9H,1-5H3
(3)InChIKey: VFIKPDSQDNROGM-UHFFFAOYSA-N

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