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5-Fluoro-2-methylbenzonitrile

Uses
Product Name
5-Fluoro-2-methylbenzonitrile
CAS No.
77532-79-7
Chemical Name
5-Fluoro-2-methylbenzonitrile
Synonyms
5-Fluoro-2-methylben;5-FLUORO-O-TOLUNITRILE;2-cyano-4-fluorotoluene;Methyl-5-fluorobenzonitrile;5-FLUORO-2-METHYLBENZONITRILE;2-methyl-5-fluorobenzonitrile;5-Fluoro-o-tolunitrile (CN=1);5-Fluoro-2-methylbenzonitrile>Benzonitrile, 5-fluoro-2-methyl-;5-Fluoro-2-methylbenzonitrile 98%
CBNumber
CB7286391
Molecular Formula
C8H6FN
Formula Weight
135.14
MOL File
77532-79-7.mol
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5-Fluoro-2-methylbenzonitrile Property

Melting point:
43-45 °C (lit.)
Boiling point:
230°C (rough estimate)
Density 
1.1203 (estimate)
Flash point:
175 °F
storage temp. 
Sealed in dry,Room Temperature
solubility 
soluble in Methanol
form 
powder to crystal
color 
White to Light yellow to Light orange
BRN 
7700578
InChI
InChI=1S/C8H6FN/c1-6-2-3-8(9)4-7(6)5-10/h2-4H,1H3
InChIKey
IBRODYNXELBTJC-UHFFFAOYSA-N
SMILES
C(#N)C1=CC(F)=CC=C1C
CAS DataBase Reference
77532-79-7(CAS DataBase Reference)
NIST Chemistry Reference
5-Fluoro-2-methylbenzonitrile(77532-79-7)
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Safety

Hazard Codes 
Xi,T
Risk Statements 
37/38-41
Safety Statements 
26-39
RIDADR 
3276
WGK Germany 
3
Hazard Note 
Toxic
HazardClass 
6.1
PackingGroup 
III
HS Code 
29269090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H315Causes skin irritation

H318Causes serious eye damage

H335May cause respiratory irritation

Precautionary statements

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

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

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

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
364916
Product name
5-Fluoro-2-methylbenzonitrile
Purity
98%
Packaging
5g
Price
$31.4
Updated
2023/06/20
TCI Chemical
Product number
F0747
Product name
5-Fluoro-2-methylbenzonitrile
Purity
>98.0%(GC)
Packaging
5g
Price
$110
Updated
2025/07/31
TCI Chemical
Product number
F0747
Product name
5-Fluoro-2-methylbenzonitrile
Purity
>98.0%(GC)
Packaging
25g
Price
$104
Updated
2023/06/20
TRC
Product number
F596643
Product name
5-Fluoro-2-methylbenzonitrile
Packaging
1g
Price
$75
Updated
2021/12/16
TRC
Product number
F596643
Product name
5-Fluoro-2-methylbenzonitrile
Packaging
100mg
Price
$45
Updated
2021/12/16
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5-Fluoro-2-methylbenzonitrile Chemical Properties,Usage,Production

Uses

5-Fluoro-2-methylbenzonitrile is a yellow, low-melting-point solid that can be used as an intermediate in organic and pharmaceutical synthesis.

Chemical Properties

yellow low melting solid

General Description

5-Fluoro-2-methylbenzonitrile is an aryl fluorinated building block.

Synthesis

953422-44-1

77532-79-7

The general procedure for the synthesis of 5-fluoro-2-methylbenzonitrile from the compound (CAS: 953422-44-1) was as follows: aldoxime (1 mmol) and imidazole (3 mmol) were dissolved in anhydrous dichloromethane (10-15 mL) under nitrogen protection, added to a pre-oven-dried round-bottomed flask, and the reaction mixture was stirred at room temperature.After 20 min, the reaction mixture was stirred via syringe under After 20 min, trifluoromethanesulfonic anhydride (0.4-1.0 mmol) was slowly added dropwise via syringe under nitrogen protection and the reaction mixture was continued to be stirred at room temperature for a specific time (see Table 1). The reaction process was monitored by thin layer chromatography (TLC) and/or gas chromatography-mass spectrometry (GC-MS). Upon completion of the reaction, the reaction was quenched with dilute sodium bicarbonate (NaHCO3) solution and the product was extracted with dichloromethane. The solvent was removed by concentration under reduced pressure to give the crude product, which was subsequently purified by preparative thin-layer chromatography (TLC) using a solvent mixture of ethyl acetate-hexane (80:20) to give the target nitrile analogs in 61-88% yield. The structure of the products was confirmed by melting point (mp) or boiling point (bp), TLC, infrared spectroscopy (IR), GC-MS, 1H nuclear magnetic resonance (NMR), and 13C NMR data in comparison with authentic samples commercially purchased or prepared by literature methods.

References

[1] Tetrahedron Letters, 2011, vol. 52, # 40, p. 5184 - 5187

5-Fluoro-2-methylbenzonitrile Preparation Products And Raw materials

Raw materials

Preparation Products

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5-Fluoro-2-methylbenzonitrile 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
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64
Dongyang Qiusuo Medical Technology Co., LTD
Tel
17502510579
Email
2785299132@qq.com
Country
China
ProdList
1558
Advantage
58
J & K SCIENTIFIC LTD.
Tel
18210857532; 18210857532
Fax
86-10-82849933
Email
jkinfo@jkchemical.com
Country
China
ProdList
96815
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76
Alfa Aesar
Tel
400-6106006
Fax
021-67582001/03/05
Email
saleschina@alfa-asia.com
Country
China
ProdList
30123
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TCI (Shanghai) Development Co., Ltd.
Tel
021-67121386
Fax
021-67121385
Email
Sales-CN@TCIchemicals.com
Country
China
ProdList
24529
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81
Energy Chemical
Tel
021-021-58432009 400-005-6266
Fax
021-58436166
Email
sales8178@energy-chemical.com
Country
China
ProdList
44801
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Shijiazhuang Sdyano Fine Chemical Co., Ltd.
Tel
0311-89250318 031166536426
Fax
4000311741
Email
master@sjzsdyn.com
Country
China
ProdList
2807
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Wuhan Chemwish Technology Co., Ltd
Tel
86-027-67849912
Fax
86-027-87531808
Email
sales@chemwish.com
Country
China
ProdList
35896
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Capot Chemical Co., Ltd
Tel
+86 (0) 571 85 58 67 18
Fax
0086-571-85864795
Country
China
ProdList
18207
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66
JinYan Chemicals(ShangHai) Co.,Ltd.
Tel
13817811078
Fax
86-021-50426522,50426273
Email
sales@jingyan-chemical.com
Country
China
ProdList
9976
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60
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View Lastest Price from 5-Fluoro-2-methylbenzonitrile manufacturers

Henan Aochuang Chemical Co.,Ltd.
Product
5-Fluoro-2-methylbenzonitrile 77532-79-7
Price
US $0.00-0.00/KG
Min. Order
1KG
Purity
98%
Supply Ability
1ton
Release date
2022-10-18
Career Henan Chemical Co
Product
5-Fluoro-2-methylbenzonitrile 77532-79-7
Price
US $1.00/KG
Min. Order
1KG
Purity
98%HPLC
Supply Ability
10 tons/month
Release date
2020-01-07

77532-79-7, 5-Fluoro-2-methylbenzonitrileRelated Search:


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