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2-(2,3,5-trifluorophenyl)acetonitrile

2-(2,3,5-trifluorophenyl)acetonitrile structure

CAS No:
243666-14-0
Formula:
C8H4F3N
Chemical Name:
2-(2,3,5-trifluorophenyl)acetonitrile
Synonyms:
2,3,5-Trifluorophenylacetonitrile; 2,3,5-Trifluorobenzyl cyanide;

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2-(2,3,5-trifluorophenyl)acetonitrile Basic Attributes

Molecular Weight：

171.11900

Exact Mass：

171.02958362

DSSTox ID：

DTXSID50380728

HScode：

2926909090

Characteristics

PSA：

23.79000

XLogP3：

2.16998

Density：

1.334g/cm3

Boiling Point：

206ºC at 760 mmHg

Flash Point：

78.4ºC

Refractive Index：

1.468

Vapor Pressure：

0.242mmHg at 25°C

Safety Information

Transport codes：

UN 3276

hazard class code：

R20/21/22

safety instructions：

S26; S36/37/39

Marks：

Computed Properties

Molecular Weight:171.12
XLogP3:1.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:171.02958362
Monoisotopic Mass:171.02958362
Topological Polar Surface Area:23.8
Heavy Atom Count:12
Complexity:198
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(2,3,5-trifluorophenyl)acetonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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