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2-Fluoro-4-(trifluoromethyl)benzeneacetonitrile

2-Fluoro-4-(trifluoromethyl)benzeneacetonitrile structure

CAS No:
239087-11-7
Formula:
C9H5F4N
Chemical Name:
2-Fluoro-4-(trifluoromethyl)benzeneacetonitrile
Synonyms:
Benzeneacetonitrile,2-fluoro-4-(trifluoromethyl)-;2-Fluoro-4-(trifluoromethyl)benzeneacetonitrile;(2-Fluoro-4-trifluoromethylphenyl)acetonitrile;2-[2-Fluoro-4-(trifluoromethyl)phenyl]acetonitrile

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2-Fluoro-4-(trifluoromethyl)benzeneacetonitrile Basic Attributes

Molecular Weight：

203.13600

Exact Mass：

203.14

DSSTox ID：

DTXSID50372168

HScode：

2926909090

Characteristics

PSA：

23.79000

XLogP3：

2.91058

Density：

1.324g/cm3

Boiling Point：

219ºC at 760mmHg

Flash Point：

105.9ºC

Refractive Index：

1.443

Vapor Pressure：

0.122mmHg at 25°C

Safety Information

Marks：

Computed Properties

Molecular Weight:203.14
XLogP3:2.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:203.03581181
Monoisotopic Mass:203.03581181
Topological Polar Surface Area:23.8
Heavy Atom Count:14
Complexity:239
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Fluoro-4-(trifluoromethyl)benzeneacetonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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