2-Fluoro-6-methoxybenzonitrile
- Product Name
- 2-Fluoro-6-methoxybenzonitrile
- CAS No.
- 94088-46-7
- Chemical Name
- 2-Fluoro-6-methoxybenzonitrile
- Synonyms
- BUTTPARK 45\03-64;6-FLUORO-O-ANISONITRILE;2-CYANO-3-FLUOROANISOLE;uoro-6-methoxybenzonitriL;2-Fluoro-6-Methoxycyanobenzene;2-FLUORO-6-METHOXYBENZONITRILE;2-methoxy-6-fluorobenzonitrile;2-FLUORO-6-DIMETHOXYBENZONITRILE;Benzonitrile, 2-fluoro-6-Methoxy-;2-Fluoro-6-methoxybenzonitrile98%
- CBNumber
- CB2772057
- Molecular Formula
- C8H6FNO
- Formula Weight
- 151.14
- MOL File
- 94088-46-7.mol
2-Fluoro-6-methoxybenzonitrile Property
- Melting point:
- 103-105 °C(lit.)
- Boiling point:
- 232.1±20.0 °C(Predicted)
- Density
- 1.18±0.1 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- soluble in Methanol
- form
- powder to crystal
- color
- White to Almost white
- BRN
- 4179192
- InChI
- InChI=1S/C8H6FNO/c1-11-8-4-2-3-7(9)6(8)5-10/h2-4H,1H3
- InChIKey
- YPMSIWYNTPSPMV-UHFFFAOYSA-N
- SMILES
- C(#N)C1=C(OC)C=CC=C1F
- CAS DataBase Reference
- 94088-46-7(CAS DataBase Reference)
- NIST Chemistry Reference
- Benzonitrile, 2-fluoro-6-methoxy-(94088-46-7)
Safety
- Hazard Codes
- Xi,T,Xn
- Risk Statements
- 36/37/38-20/21/22
- Safety Statements
- 26-36
- RIDADR
- 3276
- WGK Germany
- 3
- Hazard Note
- Toxic
- HazardClass
- 6.1
- PackingGroup
- III
- HS Code
- 2926907090
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- 406058
- Product name
- 2-Fluoro-6-methoxybenzonitrile
- Purity
- 98%
- Packaging
- 10g
- Price
- $179
- Updated
- 2023/06/20
- Product number
- F0969
- Product name
- 2-Fluoro-6-methoxybenzonitrile
- Purity
- >98.0%(GC)
- Packaging
- 5g
- Price
- $49
- Updated
- 2025/07/31
- Product number
- F0969
- Product name
- 2-Fluoro-6-methoxybenzonitrile
- Purity
- >98.0%(GC)
- Packaging
- 25g
- Price
- $169
- Updated
- 2025/07/31
- Product number
- F595803
- Product name
- 2-Fluoro-6-methoxybenzonitrile
- Packaging
- 10g
- Price
- $65
- Updated
- 2021/12/16
- Product number
- PC3817F
- Product name
- 2-Fluoro-6-methoxybenzonitrile
- Purity
- 98%
- Packaging
- 100g
- Price
- $61
- Updated
- 2021/12/16
2-Fluoro-6-methoxybenzonitrile Chemical Properties,Usage,Production
Chemical Properties
White crystals
General Description
2-Fluoro-6-methoxybenzonitrile (FMBN) is a fluorinated organic building block used in organic synthesis. Molecular structure and vibrational spectra of FMBN have been investigated.
Synthesis
1897-52-5
124-41-4
94088-46-7
Synthetic route 2.1.5: 2-fluoro-6-methoxybenzonitrile (similar to WO 99/14187): 640.5 g (4.6 mol) of 2,6-difluorobenzonitrile was dissolved in 3.5 L of methanol and subsequently cooled to 0-5 °C. In this temperature range, 828.8 g of 30% sodium methanol solution was slowly added dropwise. After the dropwise addition, the reaction mixture was stirred at room temperature overnight. After completion of the reaction, the mixture was poured into 20 L of water and the precipitate was collected by filtration. The precipitate was washed sequentially twice with water and twice with heptane. The resulting solid was dried under vacuum at 50 °C. A final 740 g of white solid product was obtained in 99% yield of the theoretical value. The product was analyzed by GC and 1H NMR (CDCl3 as solvent) and the purity of the product was >95%.1H NMR data were as follows: δ = 3.95 ppm (single peak, 3H, O-CH3), 6.85 ppm (multiple peaks, 2H, aromatic H), 7.5 ppm (quadruple peak, 1H, aromatic H).
References
[1] Patent: WO2006/56433, 2006, A2. Location in patent: Page/Page column 29
[2] Journal of Heterocyclic Chemistry, 1988, vol. 25, p. 1173 - 1177
[3] Patent: WO2007/93530, 2007, A1. Location in patent: Page/Page column 244
[4] Journal of Medicinal Chemistry, 2012, vol. 55, # 7, p. 3135 - 3143
[5] Patent: WO2017/221092, 2017, A1. Location in patent: Paragraph 00153
2-Fluoro-6-methoxybenzonitrile Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 2-Fluoro-6-methoxybenzonitrile manufacturers
- Product
- 2-Fluoro-6-methoxybenzonitrile 94088-46-7
- Price
- US $0.00-0.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 20 mt
- Release date
- 2024-11-21
- Product
- 2-Fluoro-6-Methoxybenzonitrile 94088-46-7
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 98% HPLC
- Supply Ability
- 10 tons/month
- Release date
- 2020-01-09