Product Name

  • Name

    4-(2-BROMOETHOXY)PHENYLBORONIC ACID PINACOL ESTER

  • EINECS
  • CAS No. 913836-27-8
  • Article Data2
  • CAS DataBase
  • Density 1.27g/cm3
  • Solubility
  • Melting Point 90-92°C
  • Formula C14H20BBrO3
  • Boiling Point 391.9 °C at 760 mmHg
  • Molecular Weight 327.026
  • Flash Point 190.8 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 913836-27-8 (4-(2-BROMOETHOXY)PHENYLBORONIC ACID PINACOL ESTER)
  • Hazard Symbols IrritantXi
  • Synonyms 2-[4-(2-Bromoethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;
  • PSA 27.69000
  • LogP 2.75950

1,3,2-Dioxaborolane,2-[4-(2-bromoethoxy)phenyl]-4,4,5,5-tetramethyl- Specification

The 1,3,2-Dioxaborolane,2-[4-(2-bromoethoxy)phenyl]-4,4,5,5-tetramethyl-, with CAS registry number 913836-27-8, belongs to the following product categories: (1)Blocks; (2)Boronic Acids; (3)Bromides. It has the systematic name of 2-[4-(2-bromoethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane. And the chemical formula of  this chemical is C14H20BBrO3.

Physical properties of 1,3,2-Dioxaborolane,2-[4-(2-bromoethoxy)phenyl]-4,4,5,5-tetramethyl-: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 27.69 Å2; (5)Index of Refraction: 1.52; (6)Molar Refractivity: 78.18 cm3; (7)Molar Volume: 256.9 cm3; (8)Polarizability: 30.99×10-24cm3; (9)Surface Tension: 36.9 dyne/cm; (10)Density: 1.27 g/cm3; (11)Flash Point: 190.8 °C; (12)Enthalpy of Vaporization: 61.65 kJ/mol; (13)Boiling Point: 391.9 °C at 760 mmHg; (14)Vapour Pressure: 5.38E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: B1(OC(C(O1)(C)C)(C)C)c2ccc(cc2)OCCBr
(2)InChI: InChI=1/C14H20BBrO3/c1-13(2)14(3,4)19-15(18-13)11-5-7-12(8-6-11)17-10-9-16/h5-8H,9-10H2,1-4H3
(3)InChIKey: NTTOMYNPPZBRBG-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C14H20BBrO3/c1-13(2)14(3,4)19-15(18-13)11-5-7-12(8-6-11)17-10-9-16/h5-8H,9-10H2,1-4H3
(5)Std. InChIKey: NTTOMYNPPZBRBG-UHFFFAOYSA-N

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