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2-Fluoro-5-nitrobenzonitrile

2-Fluoro-5-nitrobenzonitrile structure

CAS No:
17417-09-3
Formula:
C7H3FN2O2
Chemical Name:
2-Fluoro-5-nitrobenzonitrile
Synonyms:
2-FLUORO-5-NITROBENZONITRILE;BUTTPARK 33\08-18;2-Fluoro-5-nitrobenzonitrile 97%;2-Fluoro-5-nitrobenzonitrile97%;3-Cyano-4-fluoro-1-nitrobenzene;2-Fluoro-5-nitrobenzonitrile, 98+%;3-Cyano-4-fluoronitrobenzene;2-Fluoro-5-nitrobenzenenitrile
Categories:
Organic Chemistry > Organic Fluorine Compound

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Description

white to light yellow crystal powder

2-Fluoro-5-nitrobenzonitrile Basic Attributes

Molecular Weight：

166.11

Exact Mass：

166.01800

BRN：

2048720

EC Number：

1592732-453-0

DSSTox ID：

DTXSID20334011

HScode：

29269090

Characteristics

PSA：

69.6

XLogP3：

1.6

Appearance：

white to light yellow crystal powder

Density：

1.41±0.1 g/cm3(Predicted)

Melting Point：

76-80 °C(lit.)

Boiling Point：

94 °C / 0.5mmHg

Flash Point：

111.4ºC

Refractive Index：

1.503

Vapor Pressure：

0.0608mmHg at 25°C

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

3439

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36-36/37/39

Marks：

Xn,Xi

Hazard note：

Irritant

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302-H312-H315-H319-H332-H335

GHS Classification：

|Warning|H302 (95.65%): 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 46 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:166.11
XLogP3:1.6
Hydrogen Bond Acceptor Count:4
Exact Mass:166.01785550
Monoisotopic Mass:166.01785550
Topological Polar Surface Area:69.6
Heavy Atom Count:12
Complexity:229
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-Fluoro-5-nitrobenzonitrile

CAS No.: 17417-09-3

Content: 99.00%

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Guide of 2-Fluoro-5-nitrobenzonitrile

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
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2-Fluoro-5-nitrobenzonitrile

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