1,2-Bis(di-tert-butyl phosphinomethyl)benzene structure
|
Common Name | 1,2-Bis(di-tert-butyl phosphinomethyl)benzene | ||
|---|---|---|---|---|
| CAS Number | 121954-50-5 | Molecular Weight | 394.554 | |
| Density | N/A | Boiling Point | 456.7±38.0 °C at 760 mmHg | |
| Molecular Formula | C24H44P2 | Melting Point | 59-62ºC | |
| MSDS | Chinese USA | Flash Point | 243.6±33.1 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]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 | 456.7±38.0 °C at 760 mmHg |
|---|---|
| Melting Point | 59-62ºC |
| Molecular Formula | C24H44P2 |
| Molecular Weight | 394.554 |
| Flash Point | 243.6±33.1 °C |
| Exact Mass | 394.291809 |
| PSA | 27.18000 |
| LogP | 8.05 |
| Appearance of Characters | crystal | white |
| Vapour Pressure | 0.0±1.1 mmHg at 25°C |
| InChIKey | SFCNPIUDAIFHRD-UHFFFAOYSA-N |
| SMILES | CC(C)(C)P(Cc1ccccc1CP(C(C)(C)C)C(C)(C)C)C(C)(C)C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
|
Section 1: Product Identification Chemical Name:alpha,alpha'-Bis(di-t-butylphosphino)-o-xylene, min. 97% CAS Registry Number:121954-50-5 Formula:C6H4[CH2P(C4H9)2]2 EINECS Number:none Chemical Family:organophosphine ligand Synonym:1,2-Bis(di-t-butylphosphinomethyl)benzene
Section 2: Composition and Information on Ingredients IngredientCAS NumberPercentACGIH (TWA)OSHA (PEL) Title compound121954-50-5100%no datano data Section 3: Hazards Identification Emergency Overview:Irritating to skin, eyes and respiratory tract. May be harmful if swallowed. Primary Routes of Exposure:Ingestion, inhalation Eye Contact:Causes slight to mild irritation of the eyes Skin Contact:Causes slight to mild irritation of the skin. Inhalation:Irritating to the nose, mucous membranes and respiratory tract. Ingestion:No specific information is available on the physiological effects of ingestion. May be harmful if swallowed. Acute Health Affects:Irritating to skin, eyes and respiratory tract. Chronic Health Affects:No information available on the effects of long-term exposure. NTP:No IARC:No OSHA:No SECTION 4: First Aid Measures Immediately flush the eyes with copious amounts of water for at least 10-15 minutes. A victim may need Eye Exposure: assistance in keeping their eye lids open. Get immediate medical attention. Wash the affected area with water. Remove contaminated clothes if necessary. Seek medical assistance if Skin Exposure: irritation persists. Remove the victim to fresh air. Closely monitor the victim for signs of respiratory problems, such as difficulty Inhalation: in breathing, coughing, wheezing, or pain. In such cases seek immediate medical assistance. Seek medical attention immediately. Keep the victim calm. Give the victim water (only if conscious). Induce Ingestion: vomiting only if directed by medical personnel. SECTION 5: Fire Fighting Measures Flash Point:no data Autoignition Temperature:none Explosion Limits:none Extinguishing Medium:carbon dioxide, dry powder or foam If this material is involved in a fire, fire fighters should be equipped with a NIOSH approved positive pressure Special Fire Fighting Procedures: self-contained breathing apparatus and full protective clothing. Hazardous Combustion andIf involved in a fire this material may emit toxic organic fumes. Decomposion Products: Unusual Fire or Explosion Hazards: Flammable solid. No unusual fire or explosion hazards. SECTION 6: Accidental Release Measures Spill and Leak Procedures:Small spills can be mixed with vermiculite or sodium carbonate and swept up. SECTION 7: Handling and Storage Handling and Storage:Material will degrade on exposure to air. Handle and store under an inert atmosphere of nitrogen or argon. SECTION 8: Exposure Controls and Personal Protection Eye Protection:Always wear approved safety glasses when handling a chemical substance in the laboratory. Skin Protection:Wear protective clothing and gloves. Ventilation:Material may form a fine dust. If possible, handle the material in an efficient fume hood. If ventilation is not available a respirator should be worn. The use of respirators requires a Respirator Respirator: Protection Program to be in compliance with 29 CFR 1910.134. Ventilation:Material may form a fine dust. If possible, handle the material in an efficient fume hood. Additional Protection:No additional protection required. SECTION 9: Physical and Chemical Properties Color and Form:white xtl. Molecular Weight:394.56 Melting Point:59-62° Boiling Point:no data Vapor Pressure:no data Specific Gravity:no data Odor:no data Solubility in Water:no data SECTION 10: Stability and Reactivity Stability:air-sensitive solid Hazardous Polymerization:none Conditions to Avoid:none Incompatibility:oxidizing agents, halogens Decomposition Products:carbon dioxide, carbon monoxide, organic fumes, and phosphorus oxides. SECTION 11: Toxicological Information RTECS Data:No information available in the RTECS files. Carcinogenic Effects:No data available Mutagenic Effects:No data available Tetratogenic Effects:No data available SECTION 12: Ecological Information Ecological Information:No information available SECTION 13: Disposal Considerations Disposal:Dispose of according to local, state and federal regulations. SECTION 14: Transportation Shipping Name (CFR):Non-hazardous Hazard Class (CFR):NA Additional Hazard Class (CFR):NA Packaging Group (CFR):NA UN ID Number (CFR):NA Shipping Name (IATA):Non-hazardous Hazard Class (IATA):NA Additional Hazard Class (IATA):NA Packaging Group (IATA):NA UN ID Number (IATA):NA SECTION 15: Regulatory Information TSCA:Not listed in the TSCA inventory. SARA (Title 313):Not reportable under SARA Title 313 Second Ingredient:none SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~55%
1,2-Bis(di-tert... CAS#:121954-50-5 |
| Literature: Ineos Acrylics UK Limited Patent: US6335471 B1, 2002 ; Location in patent: Page column 4 ; |
|
~22%
1,2-Bis(di-tert... CAS#:121954-50-5 |
| Literature: Ineos Acrylics UK Limited Patent: US6335471 B1, 2002 ; Location in patent: Page column 5 ; |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| [1,2-Phenylenebis(methylene)]bis[bis(2-methyl-2-propanyl)phosphine] |
| 1,2-bis(ditertbutylphosphinomethyl)benzene |
| MFCD03094573 |
| 1,2-Bis(di-tert-butyl phosphinomethyl)benzene |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the boiling point of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane? |
| A: Boiling point of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane is 456.7±38.0 °C at 760 mmHg. |
| Q: What is the physical appearance of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane? |
| A: ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane appears as crystal | white. |
| Q: What is the InChIKey of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane? |
| A: InChIKey of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane is SFCNPIUDAIFHRD-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane? |
| A: SMILES notation of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane is CC(C)(C)P(Cc1ccccc1CP(C(C)(C)C)C(C)(C)C)C(C)(C)C. |
| Q: What is the molecular formula of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane? |
| A: Molecular formula of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane is C24H44P2. |
| Q: What is the LogP of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane? |
| A: LogP of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane is 8.05. |
| Q: What is the CAS number of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane? |
| A: CAS number of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane is 121954-50-5. |
| Q: What is the melting point of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane? |
| A: Melting point of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane is 59-62ºC. |
| Q: What is the polar surface area (PSA) of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane? |
| A: Polar surface area (PSA) of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane is 27.18000. |
| Q: What English synonyms does ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane have? |
| A: English synonyms of ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane: [1,2-Phenylenebis(methylene)]bis[bis(2-methyl-2-propanyl)phosphine], 1,2-bis(ditertbutylphosphinomethyl)benzene, MFCD03094573, 1,2-Bis(di-tert-butyl phosphinomethyl)benzene. |
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. |