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2,3,4-TRIFLUOROPHENYLACETONITRILE

2,3,4-TRIFLUOROPHENYLACETONITRILE structure

CAS No:
243666-13-9
Formula:
C8H4F3N
Chemical Name:
2,3,4-TRIFLUOROPHENYLACETONITRILE
Synonyms:
2,3,4-TRIFLUOROBENZYL CYANIDE;2,3,4-TRIFLUOROPHENYLACETONITRILE;2-(2,3,4-Trifluorophenyl)acetonitrile
Categories:
Organic Chemistry > Organic Fluorine Compound

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2,3,4-TRIFLUOROPHENYLACETONITRILE Basic Attributes

Molecular Weight：

171.12

Exact Mass：

171.03000

DSSTox ID：

DTXSID90380727

HScode：

2926909090

Characteristics

PSA：

23.8

XLogP3：

1.9

Density：

1.334g/cm3

Boiling Point：

217.2°C at 760 mmHg

Flash Point：

85.2ºC

Refractive Index：

1.468

Vapor Pressure：

0.134mmHg at 25°C

Safety Information

Hazard category：

TOXIC

Transport codes：

3276

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37/39

Marks：

Hazard note：

Toxic

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, P501

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, 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: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

Latest News on 2,3,4-TRIFLUOROPHENYLACETONITRILE

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Guide of 2,3,4-TRIFLUOROPHENYLACETONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties
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