Introduction:Basic information about CAS 121-02-8|2-Methyl-5-nitrobenzenesulfonyl chloride, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 2-Methyl-5-nitrobenzenesulfonyl chloride |
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| CAS Number | 121-02-8 | Molecular Weight | 235.64500 |
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| Density | 1.528 g/cm3 | Boiling Point | 135-137°C/0.7mm |
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| Molecular Formula | C7H6ClNO4S | Melting Point | 43 °C |
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| MSDS | ChineseUSA | Flash Point | 135-137°C/0.7mm |
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| Symbol | GHS05 | Signal Word | Danger |
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Names
| Name | 2-Methyl-5-nitrobenzenesulfonyl chloride |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.528 g/cm3 |
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| Boiling Point | 135-137°C/0.7mm |
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| Melting Point | 43 °C |
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| Molecular Formula | C7H6ClNO4S |
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| Molecular Weight | 235.64500 |
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| Flash Point | 135-137°C/0.7mm |
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| Exact Mass | 234.97100 |
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| PSA | 88.34000 |
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| LogP | 3.43470 |
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| Vapour Pressure | 2.57E-05mmHg at 25°C |
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| Index of Refraction | 1.576 |
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| InChIKey | WPGVQDHXOUAJBW-UHFFFAOYSA-N |
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| SMILES | Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Cl |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- XT8000000
- CHEMICAL NAME :
- o-Toluenesulfonyl chloride, 5-nitro-
- CAS REGISTRY NUMBER :
- 121-02-8
- BEILSTEIN REFERENCE NO. :
- 2697079
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C7-H6-Cl-N-O4-S
- MOLECULAR WEIGHT :
- 235.65
- WISWESSER LINE NOTATION :
- WSGR B1 ENW
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,1072,1986
- TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration into the eye
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,1072,1986 ** ACUTE TOXICITY DATA **
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 7470 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,1072,1986
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Safety Information
| Symbol | GHS05 |
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| Signal Word | Danger |
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| Hazard Statements | H314 |
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| Precautionary Statements | P280-P305 + P351 + P338-P310 |
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| Personal Protective Equipment | Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges |
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| Hazard Codes | C:Corrosive; |
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| Risk Phrases | R14;R29;R34 |
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| Safety Phrases | S22-S26-S30-S45-S8-S36/37/39 |
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| RIDADR | 3261 |
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| RTECS | XT8000000 |
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| Packaging Group | II |
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| Hazard Class | 8 |
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| HS Code | 2904909090 |
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Customs
| HS Code | 2904909090 |
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| 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% |
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Synonyms
| EINECS 204-444-8 |
| 2-Methyl-5-Nitrobenzene-1-Sulfonyl Chloride |
| 5-Nitro-o-toluenesulfonyl Chloride |
| 4-nitrotoluene-2-sulfochloride |
| Benzenesulfonyl chloride,2-methyl-5-nitro |
| 2-Methyl-5-nitrobenzenesulfonylchloride |
| 5-nitro-2-methyl-phenylsulfonyl chloride |
| MFCD00051695 |
| 4-Nitrotoluene-2-sulphonyl chloride |
| 2-Methyl-5-nitrobenzenesulfonyl Chloride |
| 2-methyl-5-nitro-benzene-sulfonyl chloride |
| 4-Nitrotoluen-2-sulfochlorid |
| 2-methyl-5-nitro-benzenesulphonyl chloride |
| o-Toluenesulfonyl chloride,5-nitro |
| sulfonyl chloride |
| 5-nitro-2-methylbenzenesulfonylchloride |