3-thiophenesulfonyl chloride structure
|
Common Name | 3-thiophenesulfonyl chloride | ||
|---|---|---|---|---|
| CAS Number | 51175-71-4 | Molecular Weight | 182.64800 | |
| Density | 1.58g/cm3 | Boiling Point | 101-103ºC | |
| Molecular Formula | C4H3ClO2S2 | Melting Point | 44ºC | |
| MSDS | N/A | Flash Point | 114.2ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Thiophene-3-sulfonyl chloride |
|---|---|
| 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 | 1.58g/cm3 |
|---|---|
| Boiling Point | 101-103ºC |
| Melting Point | 44ºC |
| Molecular Formula | C4H3ClO2S2 |
| Molecular Weight | 182.64800 |
| Flash Point | 114.2ºC |
| Exact Mass | 181.92600 |
| PSA | 70.76000 |
| LogP | 2.75640 |
| Index of Refraction | 1.581 |
| InChIKey | YSPWSQNKRBSICH-UHFFFAOYSA-N |
| SMILES | O=S(=O)(Cl)c1ccsc1 |
| Storage condition | Store under Nitrogen |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
Risk Phrases: 34 Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW
Causes burns.Moisture sensitive. Potential Health Effects Eye: Causes eye burns. Skin: Causes skin burns. Ingestion: Causes gastrointestinal tract burns. Inhalation: Causes chemical burns to the respiratory tract. Chronic: Not available. Section 4 - FIRST AID MEASURES Eyes: Immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately. Skin: Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Ingestion: Do not induce vomiting. Get medical aid immediately. Inhalation: Get medical aid immediately. Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Notes to Physician: Treat symptomatically and supportively. Section 5 - FIRE FIGHTING MEASURES General Information: As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. Extinguishing Media: Use foam, dry chemical, or carbon dioxide. Section 6 - ACCIDENTAL RELEASE MEASURES General Information: Use proper personal protective equipment as indicated in Section 8. Spills/Leaks: Vacuum or sweep up material and place into a suitable disposal container. Section 7 - HANDLING and STORAGE Handling: Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Use only in a chemical fume hood. Storage: Store in a cool, dry place. Store in a tightly closed container. Corrosives area. Store under nitrogen. Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION Engineering Controls: Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 51175-71-4: Personal Protective Equipment Eyes: Not available. Skin: Wear appropriate protective gloves to prevent skin exposure. Clothing: Wear appropriate protective clothing to prevent skin exposure. Respirators: Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced. Section 9 - PHYSICAL AND CHEMICAL PROPERTIES Physical State: Solid Color: colorless Odor: pungent odor pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: 101 - 103 deg C Freezing/Melting Point: 44 - 46 deg C Autoignition Temperature: Not available. Flash Point: Not available. Explosion Limits, lower: Not available. Explosion Limits, upper: Not available. Decomposition Temperature: Solubility in water: Specific Gravity/Density: Molecular Formula: C4H3ClO2S2 Molecular Weight: 183 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Not available. Conditions to Avoid: Incompatible materials, exposure to moist air or water. Incompatibilities with Other Materials: Strong oxidizing agents, bases. Hazardous Decomposition Products: Hydrogen chloride, chlorine, carbon monoxide, oxides of sulfur, carbon dioxide. Hazardous Polymerization: Has not been reported Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 51175-71-4 unlisted. LD50/LC50: Not available. Carcinogenicity: 3-Thiophenesulfonyl chloride - Not listed by ACGIH, IARC, or NTP. Section 12 - ECOLOGICAL INFORMATION Section 13 - DISPOSAL CONSIDERATIONS Dispose of in a manner consistent with federal, state, and local regulations. Section 14 - TRANSPORT INFORMATION IATA Shipping Name: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S.* Hazard Class: 8 UN Number: 3261 Packing Group: III IMO Shipping Name: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S. Hazard Class: 8 UN Number: 3261 Packing Group: III RID/ADR Shipping Name: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S. Hazard Class: 8 UN Number: 3261 Packing group: III Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: C Risk Phrases: R 34 Causes burns. Safety Phrases: S 26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 Wear suitable protective clothing, gloves and eye/face protection. S 45 In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible). WGK (Water Danger/Protection) CAS# 51175-71-4: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 51175-71-4 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 51175-71-4 is not listed on the TSCA inventory. It is for research and development use only. SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | C |
|---|---|
| Risk Phrases | R34 |
| Safety Phrases | 26-36/37/39 |
| RIDADR | UN 3261 |
| Packaging Group | Ⅲ |
| HS Code | 2934999090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~72%
3-thiophenesulf... CAS#:51175-71-4 |
| Literature: Texas Biotechnology Corp. Patent: US6342610 B2, 2002 ; Location in patent: Page column 58 ; US 6342610 B2 |
|
~%
3-thiophenesulf... CAS#:51175-71-4 |
| Literature: Debergh, J. Robb; Niljianskul, Nootaree; Buchwald, Stephen L. Journal of the American Chemical Society, 2013 , vol. 135, # 29 p. 10638 - 10641 |
|
~%
3-thiophenesulf... CAS#:51175-71-4 |
| Literature: Steinkopf et al. Justus Liebigs Annalen der Chemie, 1934 , vol. 512, p. 136,156 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 3 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| thiophene-3-sulfonyl chloride |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of Thiophene-3-sulfonyl chloride? |
| A: CAS number of Thiophene-3-sulfonyl chloride is 51175-71-4. |
| Q: What is the boiling point of Thiophene-3-sulfonyl chloride? |
| A: Boiling point of Thiophene-3-sulfonyl chloride is 101-103ºC. |
| Q: What is the safety information for Thiophene-3-sulfonyl chloride? |
| A: Safety information for Thiophene-3-sulfonyl chloride: 26-36/37/39. |
| Q: What are the downstream products of Thiophene-3-sulfonyl chloride? |
| A: Related downstream products(CAS) of Thiophene-3-sulfonyl chloride: 111711-67-2;69824-57-3;64255-63-6. |
| Q: What is the molecular formula of Thiophene-3-sulfonyl chloride? |
| A: Molecular formula of Thiophene-3-sulfonyl chloride is C4H3ClO2S2. |
| Q: What is the SMILES notation of Thiophene-3-sulfonyl chloride? |
| A: SMILES notation of Thiophene-3-sulfonyl chloride is O=S(=O)(Cl)c1ccsc1. |
| Q: What English synonyms does Thiophene-3-sulfonyl chloride have? |
| A: English synonyms of Thiophene-3-sulfonyl chloride: thiophene-3-sulfonyl chloride. |
| Q: What are the storage conditions for Thiophene-3-sulfonyl chloride? |
| A: Storage conditions for Thiophene-3-sulfonyl chloride: Store under Nitrogen. |
| Q: What is the InChIKey of Thiophene-3-sulfonyl chloride? |
| A: InChIKey of Thiophene-3-sulfonyl chloride is YSPWSQNKRBSICH-UHFFFAOYSA-N. |
| Q: What are the upstream materials of Thiophene-3-sulfonyl chloride? |
| A: Related upstream materials(CAS) of Thiophene-3-sulfonyl chloride: 872-31-1;6165-69-1;858840-32-1. |
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. |