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Home > Encyclopedia > 3-(Trifluoromethyl)phenyl triflate

3-(Trifluoromethyl)phenyl triflate

3-(Trifluoromethyl)phenyl triflate structure

3-(Trifluoromethyl)phenyl triflate 

structure
  • CAS No:

    199188-30-2

  • Formula:

    C8H4F6O3S

  • Chemical Name:

    3-(Trifluoromethyl)phenyl triflate

  • Synonyms:

    Methanesulfonic acid,1,1,1-trifluoro-,3-(trifluoromethyl)phenyl ester;Methanesulfonic acid,trifluoro-,3-(trifluoromethyl)phenyl ester;3-(Trifluoromethyl)phenyl triflate;1,1,1-Trifluoro-methanesulfonic acid 3-(trifluoromethyl)phenyl ester;3-(Trifluoromethyl)phenyl trifluoromethanesulfonate;3-Trifluoromethylphenyl trifluoromethanesulfonate

3-(Trifluoromethyl)phenyl triflate Basic Attributes

294.17100

294.17

DTXSID60443530

2906299090

Characteristics

51.75000

4.01460

1.596g/cm3

245.187ºC at 760 mmHg

102.086ºC

1.427

0.046mmHg at 25°C

Safety Information

Xi

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:294.17
XLogP3:3.6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:2
Exact Mass:293.97853413
Monoisotopic Mass:293.97853413
Topological Polar Surface Area:51.8
Heavy Atom Count:18
Complexity:379
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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