1-(2-Fluorophenyl)thiourea
1-(2-Fluorophenyl)thiourea structure
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Common Name | 1-(2-Fluorophenyl)thiourea | ||
|---|---|---|---|---|
| CAS Number | 656-32-6 | Molecular Weight | 170.207 | |
| Density | 1.4±0.1 g/cm3 | Boiling Point | 257.0±42.0 °C at 760 mmHg | |
| Molecular Formula | C7H7FN2S | Melting Point | 143-145°C | |
| MSDS | N/A | Flash Point | 109.2±27.9 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1-(2-Fluorophenyl)-2-Thiourea |
|---|---|
| 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 | 1.4±0.1 g/cm3 |
|---|---|
| Boiling Point | 257.0±42.0 °C at 760 mmHg |
| Melting Point | 143-145°C |
| Molecular Formula | C7H7FN2S |
| Molecular Weight | 170.207 |
| Flash Point | 109.2±27.9 °C |
| Exact Mass | 170.031403 |
| PSA | 70.14000 |
| LogP | 0.69 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.693 |
| InChIKey | WYVZQQOFMQRNPF-UHFFFAOYSA-N |
| SMILES | NC(=S)Nc1ccccc1F |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
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Material Safety Data Sheet
Section1. Identification of the substance Product Name: (2-Fluorophenyl)thiourea Synonyms: Section2. Hazards identification Harmful by inhalation, in contact with skin, and if swallowed. H301:Toxic if swallowed
P309:IF exposed or you feel unwell: P310:Immediately call a POISON CENTER or doctor/physician Section3. Composition/information on ingredients. Ingredient name:(2-Fluorophenyl)thiourea CAS number:656-32-6 Section4. First aid measures Skin contact:Immediately wash skin with copious amounts of water for at least 15 minutes while removing contaminated clothing and shoes. If irritation persists, seek medical attention. Eye contact:Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical attention. Inhalation:Remove to fresh air. In severe cases or if symptoms persist, seek medical attention. Ingestion:Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention. Section5. Fire fighting measures In the event of a fire involving this material, alone or in combination with other materials, use dry powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus should be worn. Section6. Accidental release measures Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national standards. Respiratory precaution:Wear approved mask/respirator Hand precaution:Wear suitable gloves/gauntlets Skin protection:Wear suitable protective clothing Eye protection:Wear suitable eye protection Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container for disposal. See section 12. Environmental precautions: Do not allow material to enter drains or water courses. Section7. Handling and storage Handling:This product should be handled only by, or under the close supervision of, those properly qualified in the handling and use of potentially hazardous chemicals, who should take into account the fire, health and chemical hazard data given on this sheet. Storage:Store in closed vessels. Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data Melting point:No data Flash point:No data Density:No data Molecular formula:C7H7FN2S Molecular weight:170.2 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, hydrogen fluoride, sulfur oxides. Section11. Toxicological information No data. Section12. Ecological information No data. Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information UN Number:UN2811 Class: 6.1 Packing group: III Proper shipping name: TOXIC SOLIDS, ORGANIC, N.O.S. ((2-Fluorophenyl)thiourea) Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | T |
|---|---|
| Risk Phrases | R25 |
| Safety Phrases | S22-S36/37/39 |
| RIDADR | 2811 |
| HS Code | 2930909090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~%
1-(2-Fluorophen... CAS#:656-32-6 |
| Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 11, # 7 p. 915 - 918 |
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~86%
1-(2-Fluorophen... CAS#:656-32-6 |
| Literature: Gupta, K. A.; Saxena, Anil K.; Jain, Padam C. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1982 , vol. 21, # 3 p. 228 - 233 |
|
~88%
1-(2-Fluorophen... CAS#:656-32-6 |
| Literature: Gupta, R. R.; Kumar, Rakesh Synthetic Communications, 1987 , vol. 17, # 2 p. 229 - 240 |
|
~%
1-(2-Fluorophen... CAS#:656-32-6 |
| Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 11, # 7 p. 915 - 918 |
|
~%
1-(2-Fluorophen... CAS#:656-32-6 |
| Literature: Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, , vol. 21, # 3 p. 228 - 233 |
|
~%
1-(2-Fluorophen... CAS#:656-32-6 |
| Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 20, # 3 p. 1177 - 1180 |
|
~%
1-(2-Fluorophen... CAS#:656-32-6 |
| Literature: Journal of the Chemical Society [Section] C: Organic, , p. 268 - 272 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 3 | |
![4-Fluorobenzo[d]thiazol-2-amine structure](https://image.chemsrc.com/caspic/459/20358-06-9.png)
CAS#:20358-06-9
CAS#:82636-12-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Screen for inhibitors of RMI FANCM (MM2) intereaction
Source: 11908
Target: N/A
External Id: RMI-FANCM-MM2
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|
Name: Discovering small molecule activators of G protein-gated inwardly-rectifying potassiu...
Source: 15621
Target: G protein-activated inward rectifier potassium channel 2
External Id: VANDERBILT_HTS_GIRK2_MPD
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-(2-Fluorophenyl)thiourea |
| (2-fluorophenyl)thiourea |
| MFCD00041148 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the downstream products of 1-(2-Fluorophenyl)-2-Thiourea? |
| A: Related downstream products(CAS) of 1-(2-Fluorophenyl)-2-Thiourea: 20358-06-9;71232-23-0;82636-12-2. |
| Q: What is the polar surface area (PSA) of 1-(2-Fluorophenyl)-2-Thiourea? |
| A: Polar surface area (PSA) of 1-(2-Fluorophenyl)-2-Thiourea is 70.14000. |
| Q: What is the CAS number of 1-(2-Fluorophenyl)-2-Thiourea? |
| A: CAS number of 1-(2-Fluorophenyl)-2-Thiourea is 656-32-6. |
| Q: What is the InChIKey of 1-(2-Fluorophenyl)-2-Thiourea? |
| A: InChIKey of 1-(2-Fluorophenyl)-2-Thiourea is WYVZQQOFMQRNPF-UHFFFAOYSA-N. |
| Q: What English synonyms does 1-(2-Fluorophenyl)-2-Thiourea have? |
| A: English synonyms of 1-(2-Fluorophenyl)-2-Thiourea: 1-(2-Fluorophenyl)thiourea, (2-fluorophenyl)thiourea, MFCD00041148. |
| Q: What is the LogP of 1-(2-Fluorophenyl)-2-Thiourea? |
| A: LogP of 1-(2-Fluorophenyl)-2-Thiourea is 0.69. |
| Q: What is the molecular weight of 1-(2-Fluorophenyl)-2-Thiourea? |
| A: Molecular weight of 1-(2-Fluorophenyl)-2-Thiourea is 170.207. |
| Q: What is the English name of 1-(2-Fluorophenyl)-2-Thiourea? |
| A: The English name of 1-(2-Fluorophenyl)-2-Thiourea is 1-(2-Fluorophenyl)-2-Thiourea. |
| Q: What is the molecular formula of 1-(2-Fluorophenyl)-2-Thiourea? |
| A: Molecular formula of 1-(2-Fluorophenyl)-2-Thiourea is C7H7FN2S. |
| Q: What is the melting point of 1-(2-Fluorophenyl)-2-Thiourea? |
| A: Melting point of 1-(2-Fluorophenyl)-2-Thiourea is 143-145°C. |
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. |