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4-Azidophenacyl bromide

4-Azidophenacyl bromide structure

CAS No:
57018-46-9
Formula:
C8H6BrN3O
Chemical Name:
4-Azidophenacyl bromide
Synonyms:
Ethanone,1-(4-azidophenyl)-2-bromo-;1-(4-Azidophenyl)-2-bromoethanone;p-Azidophenacyl bromide;4′-Azido-2-bromoacetophenone;4-Azidophenacyl bromide;p-Azidophenacetyl bromide;2-Bromo-4′-azidoacetophenone;1-(4-Azidophenyl)-2-bromoethan-1-one
Categories:
Chemical Reagents > Organic Reagents

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Description

4-AZIDOPHENACYL BROMIDE is off-White Crystalline Solid

4-Azidophenacyl bromide Basic Attributes

Molecular Weight：

240.06

Exact Mass：

238.96900

EC Number：

260-519-5

UNII：

POZ2E56V0Y

DSSTox ID：

DTXSID30205627

HScode：

29299090

Characteristics

PSA：

31.4

XLogP3：

2.65876

Appearance：

yellow powder

Melting Point：

64-65 °C

Water Solubility：

methanol: 50 mg/mL

Storage Conditions：

2-8°C

Safety Information

Packing level：

III

Hazard category：

4.1

Transport codes：

UN 1325 4.1/PG 2

wgk germany：

hazard class code：

11-34-42/43

safety instructions：

16-26-27-36/37/39-45

Marks：

F,C

Precautionary statement(s)：

P210-P261-P280-P305 + P351 + P338-P310

Hazard Statements：

H228-H314-H317-H334

GHS Classification：

|Danger|H228 (100%): Flammable solid [Danger Flammable solids]|P210, P240, P241, P260, P261, P264, P272, P280, P285, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P304+P341, P305+P351+P338, P310, P321, P333+P313, P342+P311, P363, P370+P378, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH：

Biologically active molecules which are covalently bound to the enzymes or binding proteins normally acting on them. Binding occurs due to activation of the label by ultraviolet light. These labels are used primarily to identify binding sites on proteins. (See all compounds classified as Photoaffinity Labels.)

MeSH Entry Terms：

4-azidophenacyl bromide

4-Azidophenacyl bromide Use and Manufacturing

A versatile photolabile bifunctional reagent.Useful for investigating the active sites ofsulfhydryl enzymes-particularly those which posess a particularly reactive cysteineresidue at the active site.Used to study the nature of the ribosomal binding site of E. colitRNAVal.

Computed Properties

Molecular Weight:240.06
XLogP3:3.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:238.96942
Monoisotopic Mass:238.96942
Topological Polar Surface Area:31.4
Heavy Atom Count:13
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes