Product Name

  • Name

    [4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-THIOPHEN-2-YL]-METHANOL

  • EINECS
  • CAS No. 864754-05-2
  • Density 1.15 g/cm3
  • Solubility
  • Melting Point
  • Formula C11H17BO3S
  • Boiling Point 366.6 °C at 760 mmHg
  • Molecular Weight 240.12688
  • Flash Point 175.5 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 864754-05-2 ([4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-THIOPHEN-2-YL]-METHANOL)
  • Hazard Symbols
  • Synonyms [4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-THIOPHEN-2-YL]-METHANOL;5-(HYDROXYMETHYL)THIOPHEN-3-BORONIC ACID PINACOL ESTER;5-Hydroxymethylthiophene-3-boronic acid pinacol ester;2-Hydroxymethylthiophen-4-boronic acid, pinacol ester
  • PSA 66.93000
  • LogP 1.53960

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

The 2-Thiophenemethanol,4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- is an organic compound with the formula C11H17BO3S. The IUPAC name of this chemical is [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]methanol. With the CAS registry number 864754-05-2, it is also named as 5-(Hydroxymethyl)thiophen-3-boronic acid pinacol ester.

Physical properties about 2-Thiophenemethanol,4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)- are: (1)#H bond acceptors: 3; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 66.93 Å2; (5)Index of Refraction: 1.522; (6)Molar Refractivity: 63.75 cm3; (7)Molar Volume: 208.7 cm3; (8)Polarizability: 25.27×10-24cm3; (9)Surface Tension: 39 dyne/cm; (10)Density: 1.15 g/cm3; (11)Flash Point: 175.5 °C; (12)Enthalpy of Vaporization: 64.67 kJ/mol; (13)Boiling Point: 366.6 °C at 760 mmHg; (14)Vapour Pressure: 5.11E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC1(C)OB(OC1(C)C)c2cc(CO)sc2
(2)InChI: InChI=1/C11H17BO3S/c1-10(2)11(3,4)15-12(14-10)8-5-9(6-13)16-7-8/h5,7,13H,6H2,1-4H3
(3)InChIKey: IBPANZFESPGCOB-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C11H17BO3S/c1-10(2)11(3,4)15-12(14-10)8-5-9(6-13)16-7-8/h5,7,13H,6H2,1-4H3
(5)Std. InChIKey: IBPANZFESPGCOB-UHFFFAOYSA-N

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