1-Chloro-4-methyl-2-nitrobenzene
1-Chloro-4-methyl-2-nitrobenzene structure
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Common Name | 1-Chloro-4-methyl-2-nitrobenzene | ||
|---|---|---|---|---|
| CAS Number | 89-60-1 | Molecular Weight | 171.581 | |
| Density | 1.3±0.1 g/cm3 | Boiling Point | 264.8±20.0 °C at 760 mmHg | |
| Molecular Formula | C7H6ClNO2 | Melting Point | 7 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 113.9±21.8 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-Chloro-3-nitrotoluene |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.3±0.1 g/cm3 |
|---|---|
| Boiling Point | 264.8±20.0 °C at 760 mmHg |
| Melting Point | 7 °C(lit.) |
| Molecular Formula | C7H6ClNO2 |
| Molecular Weight | 171.581 |
| Flash Point | 113.9±21.8 °C |
| Exact Mass | 171.008713 |
| PSA | 45.82000 |
| LogP | 2.80 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.570 |
| InChIKey | NWESJZZPAJGHRZ-UHFFFAOYSA-N |
| SMILES | Cc1ccc(Cl)c([N+](=O)[O-])c1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn:Harmful; |
| Risk Phrases | R20/21/22;R36/37/38 |
| Safety Phrases | S36/37/39-S26-S61 |
| RIDADR | UN 2433 6.1/PG 3 |
| WGK Germany | 3 |
| Packaging Group | III |
| Hazard Class | 6.1 |
| HS Code | 29049085 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 10 | |
CAS#:89-62-3
CAS#:106-43-4
CAS#:75508-74-6
CAS#:108-24-7
CAS#:108-88-3
CAS#:7697-37-2
CAS#:7664-93-9![2-CHLORO-5-METHYLBENZO[D]THIAZOLE structure](https://image.chemsrc.com/caspic/148/3622-31-9.png)
CAS#:3622-31-9![5-Methylbenzo[d]thiazol-2(3H)-one structure](https://image.chemsrc.com/caspic/108/40925-61-9.png)
CAS#:40925-61-9
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CAS#:27329-27-7
CAS#:98-88-4
CAS#:96-99-1This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2904909090 |
|---|---|
| Summary | HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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FT-IR, FT-Raman, ab initio, HF and DFT studies, NBO, HOMO-LUMO and electronic structure calculations on 4-chloro-3-nitrotoluene.
Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 89 , 137-48, (2012) In this work, the vibrational spectral analysis was carried out by using Raman and infrared spectroscopy in the range 100-4000 cm(-1) and 50-4000 cm(-1), respectively, for 4-chloro-3-nitrotoluene (C7H... |
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Synthesis of imidazo[1,5,4-de]quinoxalin-9-ones, benzimidazole analogues of pyrroloiminoquinone marine natural products.
Bioorg. Med. Chem. 13(2) , 387-95, (2005) The imidazoquinoxalinones 1 and 2 are benzimidazole analogues of indole-based marine natural products called makaluvamins. The stabilized cation 1 and the zwitterion 2 were prepared in approximately 9... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| toluene,4-chloro-3-nitro |
| 3-nitro-4-chlorotoluene |
| 3-nitro-4-chlorotoluol |
| M-NITRO-P-CHLOROTOLUENE |
| 4-methyl-2-nitrochlorobenzene |
| 2-Chloro-5-methylnitrobenzene |
| 3-NITRO-4-CHLORO TOLUENE |
| EINECS 201-922-8 |
| 1-Chloro-4-methyl-2-nitrobenzene |
| MFCD00007085 |
| 4,3-Chloronitrotoluene |
| 4-chloro-3-nitro-toluene |
| 4-Chloro-3-nitrotoluene |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the upstream materials of 4-Chloro-3-nitrotoluene? |
| A: Related upstream materials(CAS) of 4-Chloro-3-nitrotoluene: 89-62-3;106-43-4;75508-74-6;108-24-7;108-88-3;7697-37-2;7664-93-9. |
| Q: What is the boiling point of 4-Chloro-3-nitrotoluene? |
| A: Boiling point of 4-Chloro-3-nitrotoluene is 264.8±20.0 °C at 760 mmHg. |
| Q: What is the molecular formula of 4-Chloro-3-nitrotoluene? |
| A: Molecular formula of 4-Chloro-3-nitrotoluene is C7H6ClNO2. |
| Q: What English synonyms does 4-Chloro-3-nitrotoluene have? |
| A: English synonyms of 4-Chloro-3-nitrotoluene: toluene,4-chloro-3-nitro, 3-nitro-4-chlorotoluene, 3-nitro-4-chlorotoluol, M-NITRO-P-CHLOROTOLUENE, 4-methyl-2-nitrochlorobenzene, 2-Chloro-5-methylnitrobenzene, 3-NITRO-4-CHLORO TOLUENE, EINECS 201-922-8, 1-Chloro-4-methyl-2-nitrobenzene, MFCD00007085, 4,3-Chloronitrotoluene, 4-chloro-3-nitro-toluene, 4-Chloro-3-nitrotoluene. |
| Q: What is the polar surface area (PSA) of 4-Chloro-3-nitrotoluene? |
| A: Polar surface area (PSA) of 4-Chloro-3-nitrotoluene is 45.82000. |
| Q: What is the English name of 4-Chloro-3-nitrotoluene? |
| A: The English name of 4-Chloro-3-nitrotoluene is 4-Chloro-3-nitrotoluene. |
| Q: What is the safety information for 4-Chloro-3-nitrotoluene? |
| A: Safety information for 4-Chloro-3-nitrotoluene: S36/37/39-S26-S61. |
| Q: What is the molecular weight of 4-Chloro-3-nitrotoluene? |
| A: Molecular weight of 4-Chloro-3-nitrotoluene is 171.581. |
| Q: What is the melting point of 4-Chloro-3-nitrotoluene? |
| A: Melting point of 4-Chloro-3-nitrotoluene is 7 °C(lit.). |
| Q: What is the LogP of 4-Chloro-3-nitrotoluene? |
| A: LogP of 4-Chloro-3-nitrotoluene is 2.80. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |
| Henan Tianfu Chemical Co., Ltd. |