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3-(2-Thienyl)-5-(trifluoromethyl)isoxazole

3-(2-Thienyl)-5-(trifluoromethyl)isoxazole structure

CAS No:
175203-89-1
Formula:
C8H4F3NOS
Chemical Name:
3-(2-Thienyl)-5-(trifluoromethyl)isoxazole
Synonyms:
Isoxazole,3-(2-thienyl)-5-(trifluoromethyl)-;3-(2-Thienyl)-5-(trifluoromethyl)isoxazole;3-Thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole

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3-(2-Thienyl)-5-(trifluoromethyl)isoxazole Basic Attributes

Molecular Weight：

219.18400

Exact Mass：

219.18

DSSTox ID：

DTXSID40352954

HScode：

2934999090

Characteristics

PSA：

54.27000

XLogP3：

3.42190

Density：

1.3g/cm3

Melting Point：

112-115 °C

Boiling Point：

306.5ºC at 760 mmHg

Flash Point：

139.1ºC

Refractive Index：

1.465

Vapor Pressure：

0.000771mmHg at 25°C

Safety Information

hazard class code：

R36/37/38

safety instructions：

S26-S36

Marks：

Computed Properties

Molecular Weight:219.19
XLogP3:2.7
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:218.99656941
Monoisotopic Mass:218.99656941
Topological Polar Surface Area:54.3
Heavy Atom Count:14
Complexity:211
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(2-Thienyl)-5-(trifluoromethyl)isoxazole

Basic Attributes
Characteristics
Safety Information
Computed Properties

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