叔丁基膦

叔丁基膦 基本信息
CAS号 2501-94-2 分子式 C4H11P
分子量 90.10390 精确质量  90.05980
PSA  13.59000 LogP  1.66000

基本信息 展开↓

CAS号:
2501-94-2
3D弹球模型:
立即前往扯扯看
分子式:
C4H11P
分子量:
90.10390
中文名称:
叔丁基膦
英文名称:
tert-butylphosphane
中文别名:
叔丁基膦
英文别名:
tert-butylphosphane;
dimethyl phosphino ethane;
tert-C4H9PH2;
mono-t-butyl-phosphine;
mono-1,1-dimethylethylphosphine;
tertiary butyl phosphine;
Tert-butyl phosphine
精确分子量/精确质量:
90.05980
极性分子表面积/PSA:
13.59000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: ZGNPLWZYVAFUNZ-UHFFFAOYSA-N

物化性质展开↓

外观与性状:
大蒜气味无色液体
熔点:
4ºC
沸点:
73.3ºC at 760 mmHg
蒸汽压:
125mmHg at 25°C

安全信息展开↓

风险类别:
4.2
危险类别码:
17-26-34
安全说明:
9-43-45

合成路线查看所有的合成路线

  • 25979-07-1

    叔丁基二氯化膦

  • ~82%

  • 2501-94-2

    叔丁基膦

  • 29149-32-4

    tert-butyl(difluoro)phosphane

  • ~63%

  • 2501-94-2

    叔丁基膦

  • 115-11-7

    异丁烯

  • ~36%

  • 2501-94-2

    叔丁基膦

MSDS 展开↓


Section 1: Product Identification
   Chemical Name:       t-Butylphosphine, min. 95% TBP    
   CAS Registry Number:       2501-94-2    
   Formula:       (C4H9)PH2    
   EINECS Number:       none    
   Chemical Family:       organophosphorus ligand    
   Synonym:       tert-Butylphosphane; (1,1-dimethylethyl)phosphane; 1,1-dimethylethylphosphine    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title compound       2501-94-2       100%       no data       no data    

Section 3: Hazards Identification
   Material has an intensely pungent odor. Toxic by inhalation, in contact with skin and if swallowed. Inhalation of
   Emergency Overview:
   vapors may lead to headache and dizziness. Irritating to skin, eyes and respiratory tract.
   Primary Routes of Exposure:       Ingestion, skin, inhalation    
   Eye Contact:       Causes mild to severe irritation of the eyes.    
   Skin Contact:       Liquid may burst into flame in air causing thermal burns to skin.    
   Toxic by inhalation. Inhalation may lead to headaches and dizziness. Irritating to nose and mucous
   Inhalation:
   membranes.
   Ingestion:       Toxic if swallowed. May cause vomiting and diarrhea.    
   Acute Health Affects:       Toxic by inhalation, in contact with skin and if swallowed. Irritating to skin, eyes and respiratory tract.    
   Chronic Health Affects:       No information on long-term chronic effects.    
   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:       pyrophoric    
   Explosion Limits:       no data    
   Extinguishing Medium:       carbon dioxide, dry powder or foam    
   If this product 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 and       If involved in a fire, this material may emit toxic organic fumes and vapors of phosphorus pentoxide.    
   Decomposion Products:
   Material is pyrophoric. May spontaneously ignite if exposed to air, especially when in contact with organic
   Unusual Fire or Explosion Hazards:
   matter.

SECTION 6: Accidental Release Measures
   Small spills can be mixed with vermiculite or other suitable adsorbents. Spillage in areas not adequately
   Spill and Leak Procedures:       ventilated will require an evacuation site. Material may spontaneously ignite. Avoid static electricity.    
   Emergency response teams will require self-contained breathing apparatus.

SECTION 7: Handling and Storage
   Handling and Storage:       Material must be handled and stored 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:       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:       Handle the material in an efficient fume hood.    
   Additional Protection:       No additional protection required.    

SECTION 9: Physical and Chemical Properties
   Color and Form:       colorless liquid    
   Molecular Weight:       90.1    
   Melting Point:       no data    
   Boiling Point:       54C°    
   Vapor Pressure:       no data    
   Specific Gravity:       0.7    
   Odor:       intensely pungent odor    
   Solubility in Water:       insoluble    

SECTION 10: Stability and Reactivity
   Stability:       air sensitive liquid    
   Hazardous Polymerization:       no hazardous polymerization    
   Conditions to Avoid:       contact with air. Material may spontaneously ignite on exposure to oxygen.    
   Incompatibility:       oxidizing agents and halogens    
   Decomposition Products:       carbon monoxide, carbon dioxide, phosphorus oxides and organic fumes    

SECTION 11: Toxicological Information
   RTECS Data:       No information available in the RTECS files.    
   Carcinogenic Effects:       no data    
   Mutagenic Effects:       no data    
   Tetratogenic Effects:       no data    

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):       Pyrophoric liquids, Organic, N.O.S.    
   Hazard Class (CFR):       4.2    
   Additional Hazard Class (CFR):       NA    
   Packaging Group (CFR):       I    
   UN ID Number (CFR):       UN# 2845    
   Shipping Name (IATA):       Forbidden    
   Hazard Class (IATA):       NA    
   Additional Hazard Class (IATA):       NA    
   Packaging Group (IATA):       NA    
   UN ID Number (IATA):       UN# 2845    

SECTION 15: Regulatory Information
   TSCA:       Listed in the TSCA inventory    
   SARA (Title 313):       Title compound not listed    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A

分子结构与计算化学数据展开↓

计算化学数据


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:0

4.可旋转化学键数量:0

5.互变异构体数量:无

6.拓扑分子极性表面积:0

7.重原子数量:5

8.表面电荷:0

9.复杂度:25.1

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

上下游相关产品

上游产品

更多
  • 25979-07-1

    叔丁基二氯化膦

  • 29149-32-4

    tert-butyl(difluoro)phosphane

  • 115-11-7

    异丁烯

  • 115713-55-8

    (Et2P(CH2)2PEt2)Ni(η-Me3SiPPCMe3)

  • 115713-56-9

    CAS号:115713-56-9

下游产品

更多
  • 34557-54-5

    Methane, ion(2+)

  • 75-28-5

    2-甲基丙烷

  • 115-11-7

    异丁烯

  • 95837-79-9

    tert-butyl(methyl)phosphane

立即下载安装“化学加”APP
专业、功能强大,随时调用更加方便