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2-Chloro-6-fluorobenzeneacetonitrile

2-Chloro-6-fluorobenzeneacetonitrile structure

CAS No:
75279-55-9
Formula:
C8H5ClFN
Chemical Name:
2-Chloro-6-fluorobenzeneacetonitrile
Synonyms:
Benzeneacetonitrile,2-chloro-6-fluoro-;2-Chloro-6-fluorobenzeneacetonitrile;2-Chloro-6-fluorophenylacetonitrile;2-Chloro-6-fluorobenzyl cyanide;2-(2-Chloro-6-fluorophenyl)acetonitrile
Categories:
Chemical Reagents > Organic Reagents

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Description

WHITE CRYSTALLINE SOLID

2-Chloro-6-fluorobenzeneacetonitrile Basic Attributes

Molecular Weight：

169.58

Exact Mass：

169.58

BRN：

7423296

EC Number：

278-171-8

DSSTox ID：

DTXSID90226252

HScode：

29269095

Characteristics

PSA：

23.8

XLogP3：

2.3

Appearance：

white crystalline solid

Density：

1.3±0.1 g/cm3

Melting Point：

41-42 °C(lit.)

Boiling Point：

85°C2mm

Flash Point：

>230 °F

Refractive Index：

1.528

Water Solubility：

Insoluble in water.

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 2811 6.1/PG 1

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-37/39

Marks：

Xn,T

Hazard note：

Toxic

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302 + H312 + H332-H315-H319-H335

GHS Classification：

|Warning|H302 (88.89%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-Chloro-6-fluorobenzeneacetonitrile Use and Manufacturing

Intermediate for medicine, pesticide, liquid crystal material.

Computed Properties

Molecular Weight:169.58
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:169.0094550
Monoisotopic Mass:169.0094550
Topological Polar Surface Area:23.8
Heavy Atom Count:11
Complexity:174
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Chloro-6-fluorobenzeneacetonitrile

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Latest News
Learn More Other Chemicals

2-Chloro-6-fluorobenzeneacetonitrile

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