Product Name

  • Name

    1-Bromobenzyl methyl ether

  • EINECS
  • CAS No. 52711-30-5
  • Article Data30
  • CAS DataBase
  • Density 1.388g/cm3
  • Solubility
  • Melting Point
  • Formula C8H9BrO
  • Boiling Point 213 °C at 760 mmHg
  • Molecular Weight 201.063
  • Flash Point 84 °C
  • Transport Information
  • Appearance clear colorless to slightly yellow liquid
  • Safety
  • Risk Codes 22
  • Molecular Structure Molecular Structure of 52711-30-5 (1-Bromobenzyl methyl ether)
  • Hazard Symbols IrritantXi
  • Synonyms 2-Bromobenzyl Methyl Ether;
  • PSA 9.23000
  • LogP 2.59550

1-Bromo-2-(methoxymethyl)benzene Specification

The Benzene,1-bromo-2-(methoxymethyl)-, with the CAS registry number 52711-30-5, is also known as 2-Bromobenzyl Methyl Ether. It belongs to the product categories of Blocks; Bromides; Anisoles, Alkyloxy Compounds & Phenylacetates; Bromine Compounds. This chemical's molecular formula is C8H9BrO and molecular weight is 201.0605. What's more, its systematic name is called 1-Bromo-2-(methoxymethyl)benzene. Its appearance is clear colorless to slightly yellow liquid. When you are dealing with this chemical, you should be very careful. This chemical is irritating to the skin or other mucous membranes.

Physical properties about Benzene,1-bromo-2-(methoxymethyl)- are: (1)ACD/LogP: 2.73; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.73; (4)ACD/LogD (pH 7.4): 2.73; (5)ACD/BCF (pH 5.5): 69.83; (6)ACD/BCF (pH 7.4): 69.83; (7)ACD/KOC (pH 5.5): 727.04; (8)ACD/KOC (pH 7.4): 727.04; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.537; (13)Molar Refractivity: 45.23 cm3; (14)Molar Volume: 144.7 cm3; (15)Surface Tension: 35.7 dyne/cm; (16)Density: 1.388 g/cm3; (17)Flash Point: 84 °C; (18)Enthalpy of Vaporization: 43.1 kJ/mol; (19)Boiling Point: 213 °C at 760 mmHg; (20)Vapour Pressure: 0.244 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1ccccc1COC
(2) InChI: InChI=1/C8H9BrO/c1-10-6-7-4-2-3-5-8(7)9/h2-5H,6H2,1H3
(3) InChIKey: QFAZLCRHLRJNAW-UHFFFAOYAI

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