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1-(Trifluoroacetyl)imidazole

1-(Trifluoroacetyl)imidazole structure

CAS No:
1546-79-8
Formula:
C5H3F3N2O
Chemical Name:
1-(Trifluoroacetyl)imidazole
Synonyms:
Ethanone,2,2,2-trifluoro-1-(1H-imidazol-1-yl)-;Imidazole,1-(trifluoroacetyl)-;1H-Imidazole,1-(trifluoroacetyl)-;2,2,2-Trifluoro-1-(1H-imidazol-1-yl)ethanone;N-(Trifluoroacetyl)imidazole;1-(Trifluoroacetyl)imidazole;NSC 151965;1-Trifluoroacetylimidazolium;2,2,2-Trifluoro-1-imidazol-1-ylethanone;2,2,2-Trifluoro-1-(1H-imidazol-1-yl)ethan-1-one
Categories:
Inorganic Chemistry > Iron Compounds

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Description

Colorless to pink liquid

1-(Trifluoroacetyl)imidazole Basic Attributes

Molecular Weight：

164.087

Exact Mass：

164.09

EC Number：

216-282-5

UNII：

8C6041OW3I

NSC Number：

151965

DSSTox ID：

DTXSID60165669

HScode：

29332900

Characteristics

PSA：

34.9

XLogP3：

0.8

Appearance：

colorless to pink liquid

Density：

1.442 g/mL at 25 °C(lit.)

Boiling Point：

137-138 °C

Flash Point：

113 °F

Refractive Index：

n 20/D 1.424(lit.)

Water Solubility：

reacts

Storage Conditions：

0-6ºC

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 1993 3/PG 3

wgk germany：

hazard class code：

safety instructions：

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

Marks：

Xi,F,C

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H226-H315-H319-H335

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 45 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:164.09
XLogP3:0.8
Hydrogen Bond Acceptor Count:5
Exact Mass:164.01974721
Monoisotopic Mass:164.01974721
Topological Polar Surface Area:34.9
Heavy Atom Count:11
Complexity:168
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(Trifluoroacetyl)imidazole

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
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1-(Trifluoroacetyl)imidazole

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