4-Chloro-3-nitrotoluene
- CAS NO.：89-60-1
- Empirical Formula: C7H6ClNO2
- Molecular Weight: 171.58
- MDL number: MFCD00007085
- EINECS: 201-922-8
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-12-24 19:27:57
What is 4-Chloro-3-nitrotoluene?
Chemical properties
CLEAR YELLOW LIQUID
The Uses of 4-Chloro-3-nitrotoluene
4-Chloro-3-nitrotoluene is used in the synthesis of quinazoline-2,4(1H,3H)-dione derivatives as PARP-2 selective inhibitors.
The Uses of 4-Chloro-3-nitrotoluene
4-Chloro-3-nitrotoluene was used in the synthesis of 4-(2-hydroxyethylamino)-3-nitrotoluene.
Synthesis Reference(s)
The Journal of Organic Chemistry, 42, p. 2426, 1977 DOI: 10.1021/jo00434a017
General Description
Vibrational spectral analysis of 4-chloro-3-nitrotoluene has been studied using Raman and IR spectroscopy.
Properties of 4-Chloro-3-nitrotoluene
| Melting point: | 7 °C(lit.) |
| Boiling point: | 260 °C745 mm Hg(lit.) |
| Density | 1.297 g/mL at 25 °C(lit.) |
| refractive index | n |
| Flash point: | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| form | clear liquid |
| color | Light yellow to Yellow to Orange |
| BRN | 511055 |
| CAS DataBase Reference | 89-60-1(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzene, 1-chloro-4-methyl-2-nitro-(89-60-1) |
| EPA Substance Registry System | Benzene, 1-chloro-4-methyl-2-nitro- (89-60-1) |
Safety information for 4-Chloro-3-nitrotoluene
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Environment GHS09 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation H411:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P273:Avoid release to the environment. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 4-Chloro-3-nitrotoluene
| InChIKey | NWESJZZPAJGHRZ-UHFFFAOYSA-N |
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product: 89-60-1 3-Nitro-4-chlorotoluene 98%
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