Product Name

  • Name

    1-Methyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester

  • EINECS
  • CAS No. 454482-11-2
  • Article Data6
  • CAS DataBase
  • Density 0.97g/cm3
  • Solubility
  • Melting Point
  • Formula C12H22BNO2
  • Boiling Point 252.5 °C at 760 mmHg
  • Molecular Weight 223.123
  • Flash Point 106.5 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 454482-11-2 (1-Methyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester)
  • Hazard Symbols
  • Synonyms 1-METHYL-1,2,3,6-TETRAHYDROPYRIDINE-4-BORONIC ACID PINACOL ESTER;4,4,5,5-tetramethyl-2-(1-methyl-3,5-dihydro-2H-pyrid-4-yl)-1,3,2-dioxaborolane;1-Methyl-1,2,3,6-tetrahydro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;1-Methyl-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,6-tetrahydropyridine;1-Methyl-4-(tetraMethyl-1,3,2-dioxaborolan-2-yl)piperidine;Pyridine, 1,2,3,6-tetrahydro-1-Methyl-4-(4,4,5,5-tetraMethyl-1,3,2-dioxaborolan-2-yl)-;1-Methyl-1,2,3,6-tetrahydro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine, 2-(1-Methyl-1,2,3,6-tetrahydropyridin-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;1-Methyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester 97%
  • PSA 21.70000
  • LogP 1.81760

1-Methyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester Specification

The 1-Methyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester with its cas register number is 454482-11-2. The Systematic name about this chemical is 1-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,6-tetrahydropyridine.

Physical properties about 1-Methyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester are: (1)#H bond acceptors: 3; (2)#Freely Rotating Bonds: 1; (3)Polar Surface Area: 21.7Å2; (4)Index of Refraction: 1.482; (5)Molar Refractivity: 64.05 cm3; (6)Molar Volume: 224.3 cm3; (7)Polarizability: 25.39x10-24cm3; (8)Surface Tension: 30.9 dyne/cm; (9)Enthalpy of Vaporization: 48.98 kJ/mol; (10)Vapour Pressure: 0.0193 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC1(C)OB(OC1(C)C)C=2CCN(C)CC=2
(2)InChI: InChI=1/C12H22BNO2/c1-11(2)12(3,4)16-13(15-11)10-6-8-14(5)9-7-10/h6H,7-9H2,1-5H3
(3)InChIKey: SQMVRFXDBRYXFQ-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C12H22BNO2/c1-11(2)12(3,4)16-13(15-11)10-6-8-14(5)9-7-10/h6H,7-9H2,1-5H3
(5)Std. InChIKey: SQMVRFXDBRYXFQ-UHFFFAOYSA-N

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