2'-(dicyclohexylphosphino)acetophenone & structure
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Common Name | 2'-(dicyclohexylphosphino)acetophenone & | ||
|---|---|---|---|---|
| CAS Number | 221187-50-4 | Molecular Weight | 360.47000 | |
| Density | N/A | Boiling Point | 485.365ºC at 760 mmHg | |
| Molecular Formula | C22H33O2P | Melting Point | 85-92ºC | |
| MSDS | Chinese USA | Flash Point | 308.819ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane |
|---|---|
| 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.
| Boiling Point | 485.365ºC at 760 mmHg |
|---|---|
| Melting Point | 85-92ºC |
| Molecular Formula | C22H33O2P |
| Molecular Weight | 360.47000 |
| Flash Point | 308.819ºC |
| Exact Mass | 360.22200 |
| PSA | 32.05000 |
| LogP | 5.67870 |
| Vapour Pressure | 0mmHg at 25°C |
| InChIKey | ZQASITYRQOCACA-UHFFFAOYSA-N |
| SMILES | CC1(c2ccccc2P(C2CCCCC2)C2CCCCC2)OCCO1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
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Section1. IDENTIFICATION OF THE SUBSTANCE/MIXTURE Product identifiers : 2′-(Dicyclohexylphosphino)acetophenone ethylene Product name ketal CAS-No.: 221187-50-4
Relevant identified uses of the substance or mixture and uses advised against
Identified uses: Laboratory chemicals, Manufacture of substances Section2. HAZARDS IDENTIFICATION Classification of the substance or mixture Classification according to Regulation (EC) No 1272/2008 [EU-GHS/CLP] Chronic aquatic toxicity (Category 4) This substance is not classified as dangerous according to Directive 67/548/EEC. Label elements Labelling according Regulation (EC) No 1272/2008 [CLP] Pictogramnone Signal wordnone Hazard statement(s) H413May cause long lasting harmful effects to aquatic life. Precautionary statement(s) none Supplemental Hazardnone Statements Other hazards - none Section3. COMPOSITION/INFORMATION ON INGREDIENTS Substances Formula: C22H33O2P Molecular Weight: 360,47 g/mol ComponentConcentration 2'-(Dicyclohexylphosphino)acetophenone ethylene ketal CAS-No.221187-50-4- Section4. FIRST AID MEASURES Description of first aid measures General advice Consult a physician. Show this safety data sheet to the doctor in attendance. If inhaled If breathed in, move person into fresh air. If not breathing, give artificial respiration. Consult a physician. In case of skin contact Wash off with soap and plenty of water. Consult a physician. In case of eye contact Flush eyes with water as a precaution. If swallowed Never give anything by mouth to an unconscious person. Rinse mouth with water. Consult a physician. Most important symptoms and effects, both acute and delayed To the best of our knowledge, the chemical, physical, and toxicological properties have not been thoroughly investigated. Indication of immediate medical attention and special treatment needed no data available Section5. FIRE-FIGHTING MEASURES Extinguishing media Suitable extinguishing media Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide. Special hazards arising from the substance or mixture Carbon oxides, Oxides of phosphorus Precautions for fire-fighters Wear self contained breathing apparatus for fire fighting if necessary. Further information no data available Section6. ACCIDENTAL RELEASE MEASURES Personal precautions, protective equipment and emergency procedures Avoid dust formation. Avoid breathing vapors, mist or gas. Ensure adequate ventilation. Environmental precautions Prevent further leakage or spillage if safe to do so. Do not let product enter drains. Discharge into the environment must be avoided. Methods and materials for containment and cleaning up Pick up and arrange disposal without creating dust. Sweep up and shovel. Keep in suitable, closed containers for disposal. Reference to other sections For disposal see section 13. Section7. HANDLING AND STORAGE Precautions for safe handling Provide appropriate exhaust ventilation at places where dust is formed. Conditions for safe storage, including any incompatibilities Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Handle and store under inert gas. Air sensitive. Specific end uses no data available Section8. EXPOSURE CONTROLS/PERSONAL PROTECTION Control parameters Components with workplace control parameters Exposure controls Appropriate engineering controls Handle in accordance with good industrial hygiene and safety practice. Wash hands before breaks and at the end of workday. Personal protective equipment Eye/face protection Use equipment for eye protection tested and approved under appropriate government standards such as NIOSH (US) or EN 166(EU). Skin protection Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique (without touching glove's outer surface) to avoid skin contact with this product. Dispose of contaminated gloves after use in accordance with applicable laws and good laboratory practices. Wash and dry hands. The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and the standard EN 374 derived from it. Body Protection Choose body protection in relation to its type, to the concentration and amount of dangerous substances, and to the specific work-place., The type of protective equipment must be selected according to the concentration and amount of the dangerous substance at the specific workplace. Respiratory protection Respiratory protection is not required. Where protection from nuisance levels of dusts are desired, use type N95 (US) or type P1 (EN 143) dust masks. Use respirators and components tested and approved under appropriate government standards such as NIOSH (US) or CEN (EU). Section9. PHYSICAL AND CHEMICAL PROPERTIES Information on basic physical and chemical properties a) AppearanceForm: solid b) Odourno data available c) Odour Thresholdno data available d) pHno data available e) Melting/freezing point Melting point/range: 85 - 92 °C f) Initial boiling point and no data available boiling range g) Flash pointno data available h) Evaporation rateno data available i) Flammability (solid, gas) no data available j) Upper/lowerno data available flammability or explosive limits k) Vapour pressureno data available l) Vapour densityno data available m) Relative densityno data available n) Water solubilityno data available o) Partition coefficient: n- log Pow: 7,403 octanol/water p) Autoignitionno data available temperature q) Decompositionno data available temperature r) Viscosityno data available s) Explosive propertiesno data available t) Oxidizing propertiesno data available Other safety information no data available Section10. STABILITY AND REACTIVITY Reactivity no data available Chemical stability no data available Possibility of hazardous reactions no data available Conditions to avoid no data available Incompatible materials Strong oxidizing agents Hazardous decomposition products Other decomposition products - no data available Section11. TOXICOLOGICAL INFORMATION Information on toxicological effects Acute toxicity no data available Skin corrosion/irritation no data available Serious eye damage/eye irritation no data available Respiratory or skin sensitization no data available Germ cell mutagenicity no data available Carcinogenicity IARC:No component of this product present at levels greater than or equal to 0.1% is identified as probable, possible or confirmed human carcinogen by IARC. Reproductive toxicity no data available Specific target organ toxicity - single exposure no data available Specific target organ toxicity - repeated exposure no data available Aspiration hazard no data available Potential health effects InhalationMay be harmful if inhaled. May cause respiratory tract irritation. IngestionMay be harmful if swallowed. SkinMay be harmful if absorbed through skin. May cause skin irritation. Eyes May cause eye irritation. Signs and Symptoms of Exposure To the best of our knowledge, the chemical, physical, and toxicological properties have not been thoroughly investigated. Additional Information RTECS: Not available Section12. ECOLOGICAL INFORMATION Toxicity no data available Persistence and degradability no data available Bioaccumulative potential no data available Mobility in soil no data available Results of PBT and vPvB assessment no data available Other adverse effects no data available Section13. DISPOSAL CONSIDERATIONS Waste treatment methods Product Offer surplus and non-recyclable solutions to a licensed disposal company. Dissolve or mix the material with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber. Contaminated packaging Dispose of as unused product. Section14. TRANSPORT INFORMATION UN-Number ADR/RID: -IMDG: -IATA: - UN proper shipping name ADR/RID: Not dangerous goods IMDG:Not dangerous goods IATA:Not dangerous goods Transport hazard class(es) ADR/RID: -IMDG: -IATA: - Packaging group ADR/RID: -IMDG: -IATA: - Environmental hazards ADR/RID: noIMDG Marine pollutant: noIATA: no Special precautions for users no data available SECTION 15 - REGULATORY INFORMATION N/A SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Statements | H413 |
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| RIDADR | NONH for all modes of transport |
| HS Code | 2932999099 |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2932999099 |
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| Summary | 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Catalytic selective deuteration of halo(hetero)arenes.
Org. Biomol. Chem. 14 , 3091-7, (2016) Deuterium labeled aromatic and heteroaromatic compounds are synthesized in good to excellent yields with >98% deuterium purity via palladium catalyzed deuterodehalogenation reaction using commercially... |
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Palladium/P,O-Ligand-Catalyzed Suzuki Cross-Coupling Reactions of Arylboronic Acids and Aryl Chlorides. Isolation and Structural Characterization of (P,O)-Pd(dba) Complex.
J. Org. Chem. 64 , 6797, (1999) The phenyl backbone-derived P,O-ligands 1 and 2 were investigated for their utility as ligands in palladium/ligand-catalyzed Suzuki reactions. The 2-(2'-dicyclohexylphosphinophenyl)-2-methyl-1,3-dioxo... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Dicyclohexyl(2-(2-methyl-1,3-dioxolan-2-yl)phenyl)phosphine |
| 2-(2-dicyclohexylphosphinophenyl)-2-methyl-1,3-dioxolane |
| 2'-(Dicyclohexylphosphino)acetophenone ethylene ketal |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane? |
| A: InChIKey of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is ZQASITYRQOCACA-UHFFFAOYSA-N. |
| Q: What is the melting point of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane? |
| A: Melting point of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is 85-92ºC. |
| Q: What is the LogP of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane? |
| A: LogP of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is 5.67870. |
| Q: What is the SMILES notation of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane? |
| A: SMILES notation of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is CC1(c2ccccc2P(C2CCCCC2)C2CCCCC2)OCCO1. |
| Q: What is the CAS number of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane? |
| A: CAS number of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is 221187-50-4. |
| Q: What is the boiling point of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane? |
| A: Boiling point of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is 485.365ºC at 760 mmHg. |
| Q: What is the molecular formula of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane? |
| A: Molecular formula of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is C22H33O2P. |
| Q: What is the English name of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane? |
| A: The English name of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane. |
| Q: What English synonyms does dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane have? |
| A: English synonyms of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane: Dicyclohexyl(2-(2-methyl-1,3-dioxolan-2-yl)phenyl)phosphine, 2-(2-dicyclohexylphosphinophenyl)-2-methyl-1,3-dioxolane, 2'-(Dicyclohexylphosphino)acetophenone ethylene ketal. |
| Q: What is the molecular weight of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane? |
| A: Molecular weight of dicyclohexyl-[2-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is 360.47000. |
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. |