4-Chloro-2-nitrotoluene
- CAS NO.：89-59-8
- Empirical Formula: C7H6ClNO2
- Molecular Weight: 171.58
- MDL number: MFCD00007215
- EINECS: 201-921-2
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-11-05 11:59:00
What is 4-Chloro-2-nitrotoluene?
Chemical properties
clear brown liquid after melting
The Uses of 4-Chloro-2-nitrotoluene
4-Chloro-2-nitrotoluene can be used in the synthesis of indigo dye.
The Uses of 4-Chloro-2-nitrotoluene
4-Chloro-1-methyl-2-nitrobenzene is used in the synthesis of NMDA-glycine antagonists. Also it is used in the preparation of COX-2 inhibitor.
Production Methods
4-Chlorotoluene is nitrated with mixed acid (39/59/2) at 25 ℃ to give a mixture of 4-Chloro-2-nitrotoluene (65 %) and 4-Chloro-3-nitrotoluene (35 %) isomers. The major component is separated as the lower boiling fraction on vacuum distillation. 4-Chloro-3-nitrotoluene [89-60-1] can be obtained, if required, from the residue by distillation and sweating.
Biochem/physiol Actions
4-Chloro-2-nitrotoluene is the starting reagent for synthesis of tricyclic indole-2-carboxylic acids, a potential NMDA-glycine antagonists.
Properties of 4-Chloro-2-nitrotoluene
| Melting point: | 34-38 °C (lit.) |
| Boiling point: | 239-240 °C/718 mmHg (lit.) |
| Density | 1.2559 |
| refractive index | 1.5570 (estimate) |
| Flash point: | >230 °F |
| storage temp. | Store below +30°C. |
| form | powder to lump to clear liquid |
| color | White or Colorless to Yellow |
| Water Solubility | 109 mg/L (20 ºC) |
| BRN | 2046651 |
| CAS DataBase Reference | 89-59-8(CAS DataBase Reference) |
| NIST Chemistry Reference | 4-Chloro-2-nitrotoluene(89-59-8) |
| EPA Substance Registry System | Benzene, 4-chloro-1-methyl-2-nitro- (89-59-8) |
Safety information for 4-Chloro-2-nitrotoluene
| Signal word | Warning |
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06  Exclamation Mark Irritant GHS07  Health Hazard GHS08  Environment GHS09 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H312:Acute toxicity,dermal H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H331:Acute toxicity,inhalation H373:Specific target organ toxicity, repeated exposure H401:Hazardous to the aquatic environment, acute hazard H411:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P260:Do not breathe dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P280:Wear protective gloves/protective clothing/eye protection/face protection. P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P405:Store locked up. P501:Dispose of contents/container to..… |
Computed Descriptors for 4-Chloro-2-nitrotoluene
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product: 4-Chloro-2-Nitro Toluene
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