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2,2,2-Trifluoro-1-[4-(trifluoromethyl)phenyl]ethanone

2,2,2-Trifluoro-1-[4-(trifluoromethyl)phenyl]ethanone structure

CAS No:
74853-66-0
Formula:
C9H4F6O
Chemical Name:
2,2,2-Trifluoro-1-[4-(trifluoromethyl)phenyl]ethanone
Synonyms:
Ethanone,2,2,2-trifluoro-1-[4-(trifluoromethyl)phenyl]-;2,2,2-Trifluoro-1-[4-(trifluoromethyl)phenyl]ethanone;Trifluoromethyl p-(trifluoromethyl)phenyl ketone;Trifluoromethyl 4-(trifluoromethyl)phenyl ketone;2,2,2-Trifluoro-1-(4-(trifluoromethyl)phenyl)ethanone;α,α,α-Trifluoro-4-(trifluoromethyl)acetophenone;α,α,α-Trifluoro-p-(trifluoromethyl)acetophenone;(4-Trifluoromethylphenyl)-2,2,2-trifluoroethanone;2,2,2-Trifluoro-1-[4-(trifluoromethyl)phenyl]ethan-1-one

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2,2,2-Trifluoro-1-[4-(trifluoromethyl)phenyl]ethanone Basic Attributes

Molecular Weight：

242.11800

Exact Mass：

242.12

DSSTox ID：

DTXSID20225819

HScode：

2914700090

Characteristics

PSA：

17.07000

XLogP3：

3.45040

Density：

1.417 g/cm3

Boiling Point：

75ºC 20mm

Flash Point：

73ºC

Refractive Index：

1.415

Safety Information

Packing level：

III

Hazard category：

3.2

Transport codes：

UN 1993

hazard class code：

R36/37/38

safety instructions：

S26; S36/37/39

Marks：

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, 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.

Computed Properties

Molecular Weight:242.12
XLogP3:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:242.01663372
Monoisotopic Mass:242.01663372
Topological Polar Surface Area:17.1
Heavy Atom Count:16
Complexity:258
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,2,2-Trifluoro-1-[4-(trifluoromethyl)phenyl]ethanone

Basic Attributes
Characteristics
Safety Information
Computed Properties

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