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2-Fluoro-4-(trifluoromethyl)benzonitrile

2-Fluoro-4-(trifluoromethyl)benzonitrile structure

CAS No:
146070-34-0
Formula:
C8H3F4N
Chemical Name:
2-Fluoro-4-(trifluoromethyl)benzonitrile
Synonyms:
Benzonitrile,2-fluoro-4-(trifluoromethyl)-;2-Fluoro-4-(trifluoromethyl)benzonitrile
Categories:
Organic Chemistry > Organic Fluorine Compound

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Description

white to light yellow crystal powder

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

Molecular Weight：

189.11

Exact Mass：

189.11

BRN：

8313354

EC Number：

-0

DSSTox ID：

DTXSID90333859

HScode：

29269090

Characteristics

PSA：

23.8

XLogP3：

2.6

Appearance：

Colorless liquid.

Density：

1.358 g/mL at 25 °C(lit.)

Melting Point：

103-105 °C(lit.)

Boiling Point：

178-180°C

Flash Point：

168 °F

Refractive Index：

n 20/D 1.446(lit.)

Vapor Pressure：

0.539mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

3276

wgk germany：

hazard class code：

36/37/38-20/21/22

safety instructions：

26-36/37/39-45-36

Marks：

Xn,T,Xi

Hazard note：

Toxic

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302-H312-H315-H319-H332-H335

GHS Classification：

|Warning|H302 (97.78%): 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.

Computed Properties

Molecular Weight:189.11
XLogP3:2.6
Hydrogen Bond Acceptor Count:5
Exact Mass:189.02016175
Monoisotopic Mass:189.02016175
Topological Polar Surface Area:23.8
Heavy Atom Count:13
Complexity:226
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 146070-34-0

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Latest News on 2-Fluoro-4-(trifluoromethyl)benzonitrile

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

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Recommended Suppliers
Latest News
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2-Fluoro-4-(trifluoromethyl)benzonitrile

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