1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE
- Product Name
- 1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE
- CAS No.
- 112108-73-3
- Chemical Name
- 1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE
- Synonyms
- 2-Chloro-4-fluoro-5-nitrotoluene;2-Chloro-4-fluoro-5-nitrotoluene,97%;4-Chloro-2-fluoro-5-methylnitrobenzene;1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE;Benzene, 1-chloro-5-fluoro-2-Methyl-4-nitro-;1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE ISO 9001:2015 REACH;4-Chloro-2-fluoro-5-methylnitrobenzene, 1-Chloro-5-fluoro-2-methyl-4-nitrobenzene
- CBNumber
- CB22457963
- Molecular Formula
- C7H5ClFNO2
- Formula Weight
- 189.57
- MOL File
- 112108-73-3.mol
1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE Property
- Melting point:
- 34-36℃
- Boiling point:
- 268℃
- Density
- 1.417
- Flash point:
- 116℃
- storage temp.
- Sealed in dry,Room Temperature
- form
- Powder
- color
- Yellow
- Water Solubility
- Slightly soluble in water.
- InChI
- InChI=1S/C7H5ClFNO2/c1-4-2-7(10(11)12)6(9)3-5(4)8/h2-3H,1H3
- InChIKey
- YXVJHZWHPLOEAP-UHFFFAOYSA-N
- SMILES
- C1(Cl)=CC(F)=C([N+]([O-])=O)C=C1C
Safety
- HazardClass
- 6.1
- HS Code
- 2904990090
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
- CVT00038
- Product name
- 2-Chloro-4-fluoro-5-nitrotoluene
- Packaging
- 1 g
- Price
- $95.2
- Updated
- 2025/07/31
- Product number
- C3273
- Product name
- 2-Chloro-4-fluoro-5-nitrotoluene
- Purity
- >98.0%(GC)
- Packaging
- 5g
- Price
- $74
- Updated
- 2025/07/31
- Product number
- C3273
- Product name
- 2-Chloro-4-fluoro-5-nitrotoluene
- Purity
- >98.0%(GC)
- Packaging
- 25g
- Price
- $219
- Updated
- 2025/07/31
- Product number
- C366770
- Product name
- 2-Chloro-4-fluoro-5-nitrotoluene
- Packaging
- 5g
- Price
- $165
- Updated
- 2021/12/16
- Product number
- PC27850
- Product name
- 2-Chloro-4-fluoro-5-nitrotoluene
- Packaging
- 5g
- Price
- $14
- Updated
- 2021/12/16
1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE Chemical Properties,Usage,Production
Uses
2-Chloro-4-fluoro-5-nitrotoluene, is used as a pharmaceutical intermediate. It is also used as Ceritinib intermediate.
Synthesis
452-73-3
112108-73-3
The general procedure for the synthesis of 2-chloro-4-fluoro-5-nitrotoluene from 2-chloro-4-fluorotoluene was as follows: to a stirred concentrated solution of 2-chloro-4-fluorotoluene (2.000 g, 1.383 mmol, Aldrich, direct use), concentrated sulfuric acid (15.0 mL) was slowly added at 0°C, followed by a single addition of potassium nitrate (KNO3, 1.400 g , 1.385 mmol). The reaction mixture gradually changed to a light yellow solution, which was then warmed to 28 °C and stirred at this temperature overnight. Upon completion of the reaction, the mixture was quenched by careful pouring into ice (100 g) and extracted with ethyl acetate (2 x 100 mL). The organic phases were combined, dried over anhydrous sodium sulfate (Na2SO4), filtered and concentrated under reduced pressure to remove the solvent. The resulting oily product was further dried under vacuum to give 2.085 g (80% yield) of the target compound 2-chloro-4-fluoro-5-nitrotoluene as an oil, which was used directly in the next step of the reaction.1H NMR (CDCl3) data were as follows: δ 2.422 (s, 3H), 7.325 (d, 1H, J=10.2 Hz), 7.973 (d, 1H, J= 5.2Hz).
References
[1] Patent: WO2005/82853, 2005, A1. Location in patent: Page/Page column 210-211
[2] Patent: WO2005/75425, 2005, A2. Location in patent: Page/Page column 184-185
[3] Patent: WO2005/82862, 2005, A2. Location in patent: Page/Page column 136
[4] Journal of Medicinal Chemistry, 2013, vol. 56, # 14, p. 5675 - 5690
[5] Patent: KR2016/147358, 2016, A. Location in patent: Paragraph 0226-0228
1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE manufacturers
- Product
- 2-Chloro-4-fluoro-5-nitrotoluene 112108-73-3
- Price
- US $5.00-0.50/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- g-kg-tons, free sample is available
- Release date
- 2024-01-13
- Product
- 2-Chloro-4-fluoro-5-nitrotoluene 112108-73-3
- Price
- US $0.00-0.00/KG
- Min. Order
- 1KG
- Purity
- 98%+
- Supply Ability
- 100 tons
- Release date
- 2020-01-13
- Product
- 1-CHLORO-5-FLUORO-2-METHYL-4-NITRO-BENZENE 112108-73-3
- Price
- US $100.00/KG
- Min. Order
- 1KG
- Purity
- 98%
- Supply Ability
- 100KG
- Release date
- 2018-07-30