Product Name

  • Name

    2-(BROMOMETHYL)-2-METHYL-1,3-DIOXOLANE

  • EINECS
  • CAS No. 33278-96-5
  • Article Data10
  • CAS DataBase
  • Density 1.466 g/cm3
  • Solubility
  • Melting Point
  • Formula C5H9BrO2
  • Boiling Point 179.6 °C at 760 mmHg
  • Molecular Weight 181.03
  • Flash Point 68.3 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 33278-96-5 (2-(BROMOMETHYL)-2-METHYL-1,3-DIOXOLANE)
  • Hazard Symbols
  • Synonyms NSC99758;2-Bromomethyl-2-methyl-[1,3]-dioxolane;2-(Bromomethyl)-2-methyl-1,3-dioxolane;
  • PSA 18.46000
  • LogP 1.14430

1,3-Dioxolane,2-(bromomethyl)-2-methyl- Specification

The 1,3-Dioxolane,2-(bromomethyl)-2-methyl- is an organic compound with the formula C5H9BrO2. The IUPAC name of this chemical is 2-(Bromomethyl)-2-methyl-1,3-dioxolane. With the CAS registry number 33278-96-5, it is also named as 2-Bromomethyl-2-methyl-[1,3]-dioxolane. Besides, its molecular weight is 181.03.

The physical properties of 1,3-Dioxolane,2-(bromomethyl)-2-methyl- are: (1)ACD/LogP: 0.83; (2)#H bond acceptors: 2; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 18.46 Å2; (5)Index of Refraction: 1.464; (6)Molar Refractivity: 34.08 cm3; (7)Molar Volume: 123.4 cm3; (8)Polarizability: 13.51×10-24 cm3; (9)Surface Tension: 39.5 dyne/cm; (10)Density: 1.466 g/cm3; (11)Flash Point: 68.3 °C; (12)Enthalpy of Vaporization: 39.88 kJ/mol; (13)Boiling Point: 179.6 °C at 760 mmHg; (14)Vapour Pressure: 1.27 mmHg at 25 °C.

Preparation: this chemical can be prepared by 2,2-Dimethyl-[1,3]dioxolane. This reaction is a kind of Bromination. This reaction will need reagent bromine, catalyst di-tert-butyldicyclohexano-18-crown-18 and solvent benzene. The reaction time is 10 min with reaction temperature of 20 °C. The yield is about 93%.

1,3-Dioxolane,2-(bromomethyl)-2-methyl- can be obtained by 2,2-Dimethyl-[1,3]dioxolane

You can still convert the following datas into molecular structure:
(1)SMILES: BrCC1(OCCO1)C
(2)InChI: InChI=1/C5H9BrO2/c1-5(4-6)7-2-3-8-5/h2-4H2,1H3
(3)InChIKey: LADSNESNVGBQKO-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C5H9BrO2/c1-5(4-6)7-2-3-8-5/h2-4H2,1H3
(5)Std. InChIKey: LADSNESNVGBQKO-UHFFFAOYSA-N

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