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2-Bromo-5-methoxybenzyl bromide

2-Bromo-5-methoxybenzyl bromide structure

2-Bromo-5-methoxybenzyl bromide 

structure
  • CAS No:

    19614-12-1

  • Formula:

    C8H8Br2O

  • Chemical Name:

    2-Bromo-5-methoxybenzyl bromide

  • Synonyms:

    Benzene,1-bromo-2-(bromomethyl)-4-methoxy-;Anisole,4-bromo-3-(bromomethyl)-;1-Bromo-2-(bromomethyl)-4-methoxybenzene;2-Bromo-5-methoxybenzyl bromide;4-Bromo-3-(bromomethyl)-1-methoxybenzene;5-Methoxy-2-bromobenzyl bromide;3-Methoxy-6-bromobenzyl bromide

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

2-Bromo-5-methoxybenzyl bromide Basic Attributes

279.958

279.96

DTXSID90393317

2909309090

Characteristics

9.2

3.1

White to beige Solid

1.8±0.1 g/cm3

85-87 °C

299.6°C at 760 mmHg

120.3±21.7 °C

1.584

soluble in hot methanol. Slightly soluble in water.

0.0021mmHg at 25°C

Safety Information

8

UN 3261 8/PG 2

3

34

26-36/37/39-45

C

P280-P305 + P351 + P338-P310

H314

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 42 companies from 4 notifications to the ECHA C&L Inventory.

2-Bromo-5-methoxybenzyl bromide Use and Manufacturing

To a CCl4 solution (125 mL) of 2-bromo-5-methoxytoluene (0.050 mol) and NBS (0.055 mol) was added AIBN (0.001 mol), and the mixture was stirred at 80 °C for 18 h. The mixture was diluted with hexane before filtration through a Celite pad. Evaporation of the solvent followed by washing of the residue with ethyl acetate gave 4-bromo-3-(bromomethyl)anisole.a a a l-Bromo-2-(bromomethyl)-4-methoxybenzeneTo a solution of 173 g (0.86 mol) of l-bromo-4-methoxy-2-methylbenzene in 850 ml of CCI1-Bromo-2-(bromomethyl)-4-methoxybenzene 1-Bromo-2-(bromomethyl)-4-methoxybenzene A dry, stir bar-equipped, 3-neck 250 mL round bottom flask was fitted with a reflux condenser and put under nitrogen. 77 1-bromo-4-methoxy-2-methylbenzene (1.39 mL, 2.011 g, 10.0 mmol, 1.00 eq), 121 CClInto a 1000-mL round-bottom flask, was placed a solution of l-bromo-4-methoxy- 2-methylbenzene (20 g, 100.00 mmol, 1.00 equiv) in CCI1-Bromo-2-(bromomethyl)-4-methoxybenzene 1-Bromo-2-(bromomethyl)-4-methoxybenzene 1-2)

Computed Properties

Molecular Weight:279.96
XLogP3:3.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:279.89214
Monoisotopic Mass:277.89419
Topological Polar Surface Area:9.2
Heavy Atom Count:11
Complexity:119
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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