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2-Methyl-5-(trifluoromethyl)-1H-imidazole

2-Methyl-5-(trifluoromethyl)-1H-imidazole structure

CAS No:
33468-67-6
Formula:
C5H5F3N2
Chemical Name:
2-Methyl-5-(trifluoromethyl)-1H-imidazole
Synonyms:
1H-Imidazole,2-methyl-5-(trifluoromethyl)-;1H-Imidazole,2-methyl-4-(trifluoromethyl)-;Imidazole,2-methyl-4-(trifluoromethyl)-;2-Methyl-5-(trifluoromethyl)-1H-imidazole;2-Methyl-4(5)-trifluoromethylimidazole;2-Methyl-4-trifluoromethylimidazole;2-Methyl-4-(trifluoromethyl)-1H-imidazole
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2-Methyl-5-(trifluoromethyl)-1H-imidazole Basic Attributes

Molecular Weight：

150.1

Exact Mass：

150.10

DSSTox ID：

DTXSID80343700

HScode：

2933290090

Characteristics

PSA：

28.68000

XLogP3：

1.73690

Density：

1.355

Melting Point：

179-180 °C @ Solvent: Benzene

Boiling Point：

249 °C

Flash Point：

105ºC

Refractive Index：

1.429

PKA：

10.84±0.10

Safety Information

Hazard category：

IRRITANT

Transport codes：

UN 2811 6.1 / PGIII

hazard class code：

safety instructions：

Marks：

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:150.10
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:150.04048265
Monoisotopic Mass:150.04048265
Topological Polar Surface Area:28.7
Heavy Atom Count:10
Complexity:123
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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33468-67-6 2-methyl-5-(trifluoromethyl)-1H-imidazole

CAS No.: 33468-67-6

Grade: Industrial Grade

Content: 95%

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