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Pentafluorobenzoyl chloride

Pentafluorobenzoyl chloride structure

Pentafluorobenzoyl chloride 

structure
  • CAS No:

    2251-50-5

  • Formula:

    C7ClF5O

  • Chemical Name:

    Pentafluorobenzoyl chloride

  • Synonyms:

    Benzoyl chloride,2,3,4,5,6-pentafluoro-;Benzoyl chloride,pentafluoro-;2,3,4,5,6-Pentafluorobenzoyl chloride;Pentafluorobenzoyl chloride;Perfluorobenzoyl chloride;2,3,4,5,6-Pentafluorobenzoic acid chloride;NSC 97002

  • Categories:

    Organic Chemistry  >  Carboxylic Acids and Derivatives

Description

clear colorless to light yellow liquid


Pentafluorobenzoyl chloride is the acid chloride of pentafluorobenzoic acid. It is a sensitive derivatising reagent for the analysis of amines, amides and phenols by electron capture gas chromatography. It has a role as a chromatographic reagent. It is an acyl chloride and a perfluorinated compound. It derives from a pentafluorobenzoic acid.

Pentafluorobenzoyl chloride Basic Attributes

230.52

230.52

2054397

218-842-4

97002

DTXSID90177033

29163900

Characteristics

17.1

2.9

Clear colorless to light yellow Liquid

1.7±0.1 g/cm3

158.5 °C

None

1.445

Decomposes in water

2-8°C

Safety Information

8

UN 3265 8/PG 2

3

14-34

26-36/37/39-45

C

Corrosive/Lachrymator

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 57 companies from 5 notifications to the ECHA C&L Inventory.

Drug Information

pentafluorobenzoyl acetate

Pentafluorobenzoyl chloride Use and Manufacturing

Pentafluorobenzoyl Chloride is a useful analytical reagent in the derivatization amphetamines as well as other primary amines.

Computed Properties

Molecular Weight:230.52
XLogP3:2.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:229.9557831
Monoisotopic Mass:229.9557831
Topological Polar Surface Area:17.1
Heavy Atom Count:14
Complexity:222
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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