ChemicalBook > CAS DataBase List > 3-AMINO-4-FLUOROBENZONITRILE

3-AMINO-4-FLUOROBENZONITRILE

Product Name
3-AMINO-4-FLUOROBENZONITRILE
CAS No.
859855-53-1
Chemical Name
3-AMINO-4-FLUOROBENZONITRILE
Synonyms
CAS:859855-53-1;5-Cyano-2-fluoroaniline;3-AMINO-4-FLUOROBENZONITRILE;Benzonitrile, 3-amino-4-fluoro-;3-Amino-4-fluorobenzonitrile 98%
CBNumber
CB5688281
Molecular Formula
C7H5FN2
Formula Weight
136.13
MOL File
859855-53-1.mol
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3-AMINO-4-FLUOROBENZONITRILE Property

Melting point:
90-91°
Boiling point:
279.1±20.0 °C(Predicted)
Density 
1.25±0.1 g/cm3(Predicted)
storage temp. 
Keep in dark place,Sealed in dry,Room Temperature
pka
1.40±0.10(Predicted)
Appearance
Light yellow to brown Solid
InChI
InChI=1S/C7H5FN2/c8-6-2-1-5(4-9)3-7(6)10/h1-3H,10H2
InChIKey
BHMZMZOMQYFFQL-UHFFFAOYSA-N
SMILES
C(#N)C1=CC=C(F)C(N)=C1
CAS DataBase Reference
859855-53-1(CAS DataBase Reference)
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Safety

Hazard Codes 
Xi
RIDADR 
UN3439
Hazard Note 
Irritant
HazardClass 
6.1
HS Code 
2926907090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H312Harmful in contact with skin

H315Causes skin irritation

H319Causes serious eye irritation

H331Toxic if inhaled

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

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N-Bromosuccinimide Price

TRC
Product number
A898605
Product name
3-Amino-4-fluorobenzonitrile
Packaging
10g
Price
$130
Updated
2021/12/16
American Custom Chemicals Corporation
Product number
HCH0021118
Product name
3-AMINO-4-FLUORO BENZONITRILE
Purity
95.00%
Packaging
1G
Price
$135.45
Updated
2021/12/16
Matrix Scientific
Product number
074435
Product name
3-Amino-4-fluorobenzonitrile
Purity
95+%
Packaging
25g
Price
$102
Updated
2021/12/16
Apolloscientific
Product number
PC1805
Product name
3-Amino-4-fluorobenzonitrile
Packaging
25g
Price
$109
Updated
2021/12/16
SynQuest Laboratories
Product number
3637-3-07
Product name
3-Amino-4-fluorobenzonitrile
Purity
98%
Packaging
5G
Price
$125
Updated
2021/12/16
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3-AMINO-4-FLUOROBENZONITRILE Chemical Properties,Usage,Production

Synthesis

1009-35-4

859855-53-1

General procedure: Before each experiment, the solvent needs to be pumped through a tube-in-tube device at 16 bar hydrogen pressure for 30 min to equilibrate the system (cf. Fig. 4). An Omnifit reaction cartridge (20.0 mm outer diameter, 15.0 mm inner diameter) containing 1 g of Pd-C catalyst was used. To prevent overpressurization of the system in case of blockage, the upper pressure of the Knauer pump was set to 25 bar. with the injection loop disconnected from the flow line, the loop was opened and manually (using a syringe) injected with 3.6 mL of a 0.076 M ethanol solution of 3-nitro-4-fluorobenzonitrile (recovering the excess feedstock solution in the loop for reuse). The injection loop was then closed and switched to flow. The system outlet product is collected downstream of the backpressure regulator for 120 minutes. The solvent is removed by distillation under reduced pressure (first using a rotary evaporator and then a two-stage rotary vane pump), resulting in 3-amino-4-fluorobenzonitrile.

References

[1] Tetrahedron, 2018, vol. 74, # 47, p. 6795 - 6803
[2] Patent: US2012/196824, 2012, A1
[3] Patent: WO2011/6935, 2011, A2. Location in patent: Page/Page column 27
[4] Patent: US2008/81802, 2008, A1. Location in patent: Page/Page column 11; 12
[5] Patent: US2013/59846, 2013, A1. Location in patent: Paragraph 0448; 0449; 0450; 0451

3-AMINO-4-FLUOROBENZONITRILE Preparation Products And Raw materials

Raw materials

Preparation Products

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3-AMINO-4-FLUOROBENZONITRILE Suppliers

Shanghai Harvest Chemical Industrial Co., Ltd.
Tel
021-31038972,31038973 17321035817
Fax
+86-21-51385350
Email
sales@harvest-chem.com
Country
China
ProdList
2816
Advantage
64
Jia Xing Isenchem Co.,Ltd
Tel
0573-85285100 18627885956
Fax
0573-85285100
Email
isenchem@163.com
Country
China
ProdList
9310
Advantage
66
Alfa Aesar
Tel
400-6106006
Fax
021-67582001/03/05
Email
saleschina@alfa-asia.com
Country
China
ProdList
30123
Advantage
84
Capot Chemical Co., Ltd
Tel
+86 (0) 571 85 58 67 18
Fax
0086-571-85864795
Country
China
ProdList
18207
Advantage
66
Beijing Ouhe Technology Co., Ltd
Tel
010-010-82967028 13522913783
Fax
+86-10-82967029
Email
2355560935@qq.com
Country
China
ProdList
12000
Advantage
60
Adamas Reagent, Ltd.
Tel
400-6009262 16621234537
Fax
021-64823266
Email
chenyj@titansci.com
Country
China
ProdList
14101
Advantage
59
Shanghai Hanhong Scientific Co.,Ltd.
Tel
021-54306202 13764082696
Email
info@hanhongsci.com
Country
China
ProdList
42934
Advantage
64
Beijing Eternalchem Co,. Ltd.
Tel
010-59484199 18611897322
Email
sales@eternalchem.com
Country
China
ProdList
4383
Advantage
60
China DongFan Chemical Co.,LTD
Tel
86-0571-85151182
Fax
86-0571-85151182
Country
China
ProdList
5691
Advantage
66
China Langchem Inc.
Tel
0086-21-58956006
Fax
0086-21-58956100
Country
China
ProdList
7811
Advantage
57
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View Lastest Price from 3-AMINO-4-FLUOROBENZONITRILE manufacturers

Career Henan Chemical Co
Product
3-AMINO-4-FLUOROBENZONITRILE 859855-53-1
Price
US $3.00/KG
Min. Order
1KG
Purity
98%
Supply Ability
100kg
Release date
2019-07-04