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Phenyl bromoacetate

Phenyl bromoacetate structure

Phenyl bromoacetate 

structure
  • CAS No:

    620-72-4

  • Formula:

    C8H7BrO2

  • Chemical Name:

    Phenyl bromoacetate

  • Synonyms:

    PHENYL BROMOACETATE;alpha-Phenyl Bromoacetate;2-broMo-2-phenylacetate;Phenyl-alpha-broMoacetate;Phenyl bromoacetate 98%;Acetic acid, bromo-, phenyl ester;PhenylBromoacetate>;Bromicacidphenylester

  • Categories:

    Pharmaceutical Intermediates  >  Genetic/Enzyme Disorder

Description

Solid


Phenyl bromoacetate is an aromatic ester.

Phenyl bromoacetate Basic Attributes

215.04

213.962936

805-881-2

Off-White to Pale Beige

29159000

Characteristics

26.3

2.3

1.508 g/mL at 25 °C (lit.)

31-33 °C (lit.)

134 °C/15 mmHg (lit.)

112.2±22.6 °C

1.5500 (estimate)

Soluble in ethanol and ether, insoluble in water.

Keep in dark place,Sealed in dry,Room Temperature

Safety Information

NONH for all modes of transport

3

24/25

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Phenyl bromoacetate Use and Manufacturing

Phenyl Bromoacetate is an intermediate used to prepare 1,2,3-triazole derivatives as cannabinoid CB1 receptor antagonists. It is also used in the synthesis of [1,2,4]triazino[4,3-a] benzimidazole acetic acid derivatives as selective aldose reductase inhibitors.

Computed Properties

Molecular Weight:215.04
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:213.96294
Monoisotopic Mass:213.96294
Topological Polar Surface Area:26.3
Heavy Atom Count:11
Complexity:130
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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