15909-92-9

• 常用中文名：双(2-氰基乙基)苯基膦
• 常用英文名：bis(2-cyanoethyl)phenylphosphine
• CAS号：15909-92-9
• 分子式：C₁₂H₁₃N₂P
• 分子量：216.21900
• 相关类别： 有机原料 有机膦化合物
• 发布时间：2018-05-23 08:00:00
• 更新时间：2024-01-14 14:04:50

名称

• 中文名: 双(2-氰基乙基)苯基膦
• 英文名: 3-[2-cyanoethyl(phenyl)phosphanyl]propanenitrile
• 英文别名: MFCD00013827; 3,3'-phenylphosphanediyl-di-propionitrile; 3,3'-Phenylphosphandiyl-di-propionitril; 3,3'-phenylphosphanediyl-bis-propionitrile

物化性质

• 沸点: 176-178ºC 0,5mm
• 熔点: 72-73ºC
• 分子式: C₁₂H₁₃N₂P
• 分子量: 216.21900
• 闪点: 207.4ºC
• 精确质量: 216.08200
• PSA: 61.17000
• LogP: 2.62116
• 外观性状: crystal | colorless
• 蒸汽压: 3.08E-07mmHg at 25°C
• 储存条件:

  常温密闭避光，通风干燥

• 稳定性:

  常温常压下稳定

  避免的物料： 氧化物 空气 卤素

• 计算化学:

  1.疏水参数计算参考值（XlogP）:0.9

  2.氢键供体数量:0

  3.氢键受体数量:2

  4.可旋转化学键数量:5

  5.互变异构体数量:无

  6.拓扑分子极性表面积47.6

  7.重原子数量:15

  8.表面电荷:0

  9.复杂度:244

  10.同位素原子数量:0

  11.确定原子立构中心数量:0

  12.不确定原子立构中心数量:0

  13.确定化学键立构中心数量:0

  14.不确定化学键立构中心数量:0

  15.共价键单元数量:1

• 更多:

  1.性状：未确定

  2.密度（g/mL,25/4℃）：未确定

  3.相对蒸汽密度（g/mL,空气=1）：未确定

  4.熔点（ºC）：72-73

  5.沸点（ºC,常压）：176-178

  6.沸点（ºC,5.2kPa）：未确定

  7.折射率：未确定

  8.闪点（ºC）：176-178

  9.比旋光度（º）：未确定

  10.自燃点或引燃温度（ºC）：未确定

  11.蒸气压（kPa,25ºC）：未确定

  12.饱和蒸气压（kPa,60ºC）：未确定

  13.燃烧热（KJ/mol）：未确定

  14.临界温度（ºC）：未确定

  15.临界压力（KPa）：未确定

  16.油水（辛醇/水）分配系数的对数值：未确定

  17.爆炸上限（%,V/V）：未确定

  18.爆炸下限（%,V/V）：未确定

  19.溶解性：未确定

MSDS

Section 1: Product Identification Chemical Name:Bis(2-cyanoethyl)phenylphosphine, min. 97% CAS Registry Number:15909-92-9 Formula:(NCCH2CH2)2(C6H5)P EINECS Number:none Chemical Family:organophosphorus ligand Synonym:None Section 2: Composition and Information on Ingredients IngredientCAS NumberPercentACGIH (TWA)OSHA (PEL) Title Compound15909-92-9100%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 mild to severe 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 information on the physiological effects of ingestion. Acute Health Affects:Irritating to skin, eyes and respiratory tract. Chronic Health Affects:No information 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:no data Explosion Limits:no data 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: 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 Store in a tightly sealed container. Keep away from heat and direct sunlight. Prolonged exposure to air may Handling and Storage: result in the degradation of the product. 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:colorless xtl. Molecular Weight:216.22 Melting Point:72-73° Boiling Point:176-178°C/0.5 mm Vapor Pressure:no data Specific Gravity:no data Odor:none Solubility in Water:insoluble SECTION 10: Stability and Reactivity Stability:air sensitive solid Hazardous Polymerization:no hazardous polymerization Conditions to Avoid:prolonged contact with air Incompatibility:oxidizing agents and halogens Decomposition Products:carbon dioxide, carbon monoxide, phosphorus pentoxide, nitrogen oxides, and organic fumes. 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):Title compound not listed. Second Ingredient:none SECTION 16 - ADDITIONAL INFORMATION N/A

毒性和生态

生态学数据: 通常对水体是稍微有害的，不要将未稀释或大量产品接触地下水，水道或污水系统，未经政府许可勿将材料排入周围环境。

安全

• 风险声明 (欧洲): 20/21/22-36/37/38
• 安全声明 (欧洲): 26-36/37/39
• 危险品运输编码: UN 3439
• 包装等级: III
• 危险类别: 6.1
• 海关编码: 2926909090

合成路线

107-13-1 638-21-1 ~81% 15909-92-9

文献：Jiang, Yutong; Jiang, Qiongzhong; Zhu, Guoxin; Zhang, Xumu Tetrahedron Letters, 1997 , vol. 38, # 2 p. 215 - 218

15684-35-2 4023-53-4 137-26-8 ~68% 15909-92-9

文献：Kihara, Keiko; Suzuki, Takayoshi; Kita, Masakazu; Sunatsuki, Yukinari; Kojima, Masaaki; Takagi, Hideo D. Bulletin of the Chemical Society of Japan, 2012 , vol. 85, # 10 p. 1160 - 1166

107-13-1 638-21-1 ~% 6798-66-9 15909-92-9

文献：Doklady Akademii Nauk SSSR, , vol. 127, p. 1217 Doklady Chemistry, 124-129<1959>657

上下游产品

上游产品  5
107-13-1 638-21-1 15684-35-2 4023-53-4
137-26-8
下游产品  4
23855-87-0 23855-88-1 23848-09-1 6775-01-5

海关

海关编码	2926909090
中文概述	2926909090 其他腈基化合物. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%
申报要素	品名, 成分含量, 用途
Summary	HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%