2-AMINO-3-FLUOROBENZONITRILE
- Product Name
- 2-AMINO-3-FLUOROBENZONITRILE
- CAS No.
- 115661-37-5
- Chemical Name
- 2-AMINO-3-FLUOROBENZONITRILE
- Synonyms
- 2-Cyano-6-fluoroaniline;Amino-3-fluorobenzonitrile;2-Amino-3-fluorobenzonitrile;Benzonitrile, 2-amino-3-fluoro-;2-Amino-3-fluorobenzonitrile,95%;2-Cyano-6-fluoroaniline, 3-Fluoroanthranilonitrile
- CBNumber
- CB81091595
- Molecular Formula
- C7H5FN2
- Formula Weight
- 136.13
- MOL File
- 115661-37-5.mol
2-AMINO-3-FLUOROBENZONITRILE Property
- Boiling point:
- 252.4±25.0 °C(Predicted)
- Density
- 1.25±0.1 g/cm3(Predicted)
- storage temp.
- under inert gas (nitrogen or Argon) at 2–8 °C
- pka
- 0.42±0.10(Predicted)
- form
- Solid
- Appearance
- Off-white to light yellow Solid
- InChI
- InChI=1S/C7H5FN2/c8-6-3-1-2-5(4-9)7(6)10/h1-3H,10H2
- InChIKey
- UNISSOLHERSZOW-UHFFFAOYSA-N
- SMILES
- C(#N)C1=CC=CC(F)=C1N
Safety
- HazardClass
- TOXIC
- HazardClass
- 6.1
- HS Code
- 2926907090
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
H332Harmful if inhaled
H335May cause respiratory irritation
- 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.
N-Bromosuccinimide Price
- Product number
- A898103
- Product name
- 2-Amino-3-fluorobenzonitrile
- Packaging
- 10mg
- Price
- $45
- Updated
- 2021/12/16
- Product number
- PC9826
- Product name
- 2-Amino-3-fluorobenzonitrile
- Purity
- 97%
- Packaging
- 1g
- Price
- $10
- Updated
- 2021/12/16
- Product number
- 066864
- Product name
- 2-Amino-3-fluorobenzonitrile
- Purity
- 98%
- Packaging
- 1g
- Price
- $10
- Updated
- 2021/12/16
- Product number
- 3637-3-65
- Product name
- 2-Amino-3-fluorobenzonitrile
- Packaging
- 1g
- Price
- $16
- Updated
- 2021/12/16
- Product number
- PC9826
- Product name
- 2-Amino-3-fluorobenzonitrile
- Purity
- 97%
- Packaging
- 5g
- Price
- $32
- Updated
- 2021/12/16
2-AMINO-3-FLUOROBENZONITRILE Chemical Properties,Usage,Production
Chemical Properties
brown liquid
Uses
2-Amino-3-fluorobenzonitrile is used as an intermediate in organic synthesis and medicinal chemistry, and is mostly used in basic chemical research and modification of pharmaceutical molecules.
Synthesis
21524-39-0
115661-37-5
The general procedure for the synthesis of 2-amino-3-fluorobenzonitrile from 2,3-difluorobenzonitrile was as follows: a mixture of 2,3-difluorobenzonitrile (19.0 g, 137 mmol), pre-saturated with ammonia, and ethanol (200 mL) was placed in an autoclave and heated for 8 hr at 140 °C (final pressure 200 psi). Upon completion of the reaction, the mixture was cooled to room temperature and evaporated to dryness. The residue was dissolved in water (400 mL) and extracted with ether (2 x 300 mL). The organic phases were combined, washed sequentially with water (300 mL) and brine (250 mL), and then dried over anhydrous magnesium sulfate. After drying, the solvent was filtered and evaporated. The resulting solid was ground with isohexane (150 mL) to give 2-amino-3-fluorobenzonitrile (9.8 g, 50% yield) as an off-white solid. Its 1H NMR (360 MHz, CDCl3) data were as follows: δ 4.47 (2H, s), 6.65-6.71 (1H, m), 7.14-7.20 (2H, m).
References
[1] Journal of Medicinal Chemistry, 2009, vol. 52, # 2, p. 278 - 292
[2] Patent: US2003/55060, 2003, A1
[3] Patent: WO2003/99816, 2003, A1. Location in patent: Page 55
[4] Patent: WO2003/93272, 2003, A1. Location in patent: Page/Page column 36
[5] Journal of Medicinal Chemistry, 2006, vol. 49, # 4, p. 1235 - 1238
2-AMINO-3-FLUOROBENZONITRILE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 2-AMINO-3-FLUOROBENZONITRILE manufacturers
- Product
- 2-amino-3-fluorobenzonitrile 115661-37-5
- Price
- US $0.00/kg
- Min. Order
- 20kg
- Purity
- 99%
- Supply Ability
- 20 tons
- Release date
- 2025-04-21
- Product
- 2-AMINO-3-FLUOROBENZONITRILE 115661-37-5
- Price
- US $0.00-0.00/kg
- Min. Order
- 0.1kg
- Purity
- 98%
- Supply Ability
- 100kg
- Release date
- 2023-03-09
- Product
- 2-AMINO-3-FLUOROBENZONITRILE 115661-37-5
- Price
- US $15.00-10.00/KG
- Min. Order
- 1KG
- Purity
- 99%+ HPLC
- Supply Ability
- Monthly supply of 1 ton
- Release date
- 2021-07-10