双(二乙基胺基)磷酰氯

双(二乙基胺基)磷酰氯 基本信息
CAS号 1794-24-7 分子式 C8H20ClN2OP
分子量 226.68400 精确质量  226.10000
PSA  33.36000 LogP  3.01690

基本信息 展开↓

CAS号:
1794-24-7
3D弹球模型:
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分子式:
C8H20ClN2OP
分子量:
226.68400
中文名称:
双(二乙基胺基)磷酰氯
英文名称:
N-[chloro(diethylamino)phosphoryl]-N-ethylethanamine
中文别名:
双(二乙基胺基)磷酰氯;
双(二乙基氨基)氯酸偶膦
英文别名:
N-[chloro(diethylamino)phosphoryl]-N-ethylethanamine;
tetraethyl-phosphorodiamidic acid chloride;
EINECS 217-262-9;
tetraethylchlorophosphoramidate;
Bis(diethylamino)phosphoryl chloride;
Bis(diethylamino)phosphorochloridate;
Tetraethylphosphorodiamidic chloride;
n,n,n',n'-tetraethylphosphorodiamidic chloride;
tetraethyldiamidochlorophosphate
精确分子量/精确质量:
226.10000
极性分子表面积/PSA:
33.36000
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。
贝尔斯坦号/MDL:
MFCD00137958
EINECS:
217-262-9
InChI:
InChI=1/C8H20ClN2OP/c1-5-10(6-2)13(12-9)11(7-3)8-4/h5-8H2,1-4H3

物化性质展开↓

外观与性状:
透明无色至淡黄色液体
密度:
1.076 g/cm3
沸点:
266.6ºC
闪点:
98.7°C
折射率:
1.466-1.468
蒸汽压:
0.0396mmHg at 25°C
存储条件/存储方法:

 在干爽惰性气体下密封贮藏,储存在阴凉、干燥的地方;

避免接触湿气和水源

稳定性相关:

对湿气敏感;可与氧化剂和碱起反应

其它信息:

1.       性状:无色或灰黄色液体

2.       密度(g/mL,20 ºC):1.07

3.       相对蒸汽密度(g/mL,空气=1):未确定

4.       熔点(ºC):未确定

5.       沸点(ºC /0.3mmHg):101

6.       沸点(ºC,5.2kPa):未确定

7.       折射率:1.466-1.468

8.       闪点(ºC/0.3mmHg):101

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:与水反应

安全信息展开↓

包装等级:
II
危险类别码:
R34
安全说明:
45-36/37/39
危险标志:
C: Corrosive;

合成路线查看所有的合成路线

  • 118818-64-7

    N-[diethylamino-[(2-methylpropan-2-yl)oxy]phosphanyl]-N-ethylethanamine

  • ~89%

  • 1794-24-7

    双(二乙基胺基)磷酰氯

  • 2632-88-4

    2632-88-4

  • ~86%

  • 1794-24-7

    双(二乙基胺基)磷酰氯

  • 118818-64-7

    N-[diethylamino-[(2-methylpropan-2-yl)oxy]phosphanyl]-N-ethylethanamine

  • +

  • 78-95-5

    一氯丙酮

  • ~54%

  • 1794-24-7

    双(二乙基胺基)磷酰氯

  • +

  • 19930-31-5

    19930-31-5

毒理性展开↓

毒理学数据:

刺激眼睛、皮肤和粘膜并造成腐蚀性影响

生态数据:

对水是稍微危害的,不要让未稀或大量产品进入地下水、水道或污水系统

若无政府许可,勿将材料排入周围环境。

MSDS 展开↓

Name: Bis(diethylamino)phosphochloridate 99% Material Safety Data Sheet
Synonym:
CAS: 1794-24-7
Section 1 - Chemical Product   MSDS Name:Bis(diethylamino)phosphochloridate 99% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
1794-24-7 Bis(diethylamino)phosphochloridate 99% 217-262-9
Hazard Symbols: C
Risk Phrases: 34

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Causes burns.Moisture sensitive.
Potential Health Effects
Eye:
Causes eye burns.
Skin:
Causes skin burns.
Ingestion:
Causes gastrointestinal tract burns. The toxicological properties of this substance have not been fully investigated. May be harmful if swallowed.
Inhalation:
Causes chemical burns to the respiratory tract. Inhalation may be fatal as a result of spasm, inflammation, edema of the larynx and bronchi, chemical pneumonitis and pulmonary edema.
Chronic:
Not available.

Section 4 - FIRST AID MEASURES
  Eyes: Immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately.
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Do not induce vomiting. If victim is conscious and alert, give 2-4 cupfuls of milk or water. Get medical aid immediately.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
  General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use foam, dry chemical, or carbon dioxide.

Section 6 - ACCIDENTAL RELEASE MEASURES
  General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container.

Section 7 - HANDLING and STORAGE
  Handling:
Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Use and store under nitrogen. Use only in a chemical fume hood.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Corrosives area. Keep refrigerated. (Store below 4C/39F.)

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
  Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 1794-24-7: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
 
Physical State: Liquid
Color: Not available.
Odor: pungent odor
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 101 deg C @ .30mm H
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: 1.0700g/cm3
Molecular Formula:
Molecular Weight: 226.58

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents, strong bases, amines, alcohols.
Hazardous Decomposition Products:
Hydrogen chloride, phosphine, carbon monoxide, oxides of nitrogen, oxides of phosphorus, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 1794-24-7 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Bis(diethylamino)phosphochloridate - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
 

Section 13 - DISPOSAL CONSIDERATIONS
  Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
 
IATA
Shipping Name: CORROSIVE LIQUID, N.O.S.*
Hazard Class: 8
UN Number: 1760
Packing Group: II
IMO
Shipping Name: CORROSIVE LIQUID, N.O.S.
Hazard Class: 8
UN Number: 1760
Packing Group: II
RID/ADR
Shipping Name: CORROSIVE LIQUID, N.O.S.
Hazard Class: 8
UN Number: 1760
Packing group: II

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 34 Causes burns.
Safety Phrases:
S 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 1794-24-7: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 1794-24-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 1794-24-7 is not listed on the TSCA inventory.
It is for research and development use only.


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):无

2.氢键供体数量:0

3.氢键受体数量:3

4.可旋转化学键数量:6

5.互变异构体数量:无

6.拓扑分子极性表面积23.6

7.重原子数量:13

8.表面电荷:0

9.复杂度:165

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
  • 109-89-7

    二乙胺

  • 2632-88-4

    tetraethyldiamidophosphorous acid ethyl ester

  • 118818-64-7

    N-[diethylamino-[(2-methylpropan-2-yl)oxy]phosphanyl]-N-ethylethanamine

  • 107-20-0

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  • 1498-54-0

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下游产品

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  • 2622-07-3

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  • 67154-33-0

    3-[bis(diethylamino)phosphoryl]-1,3-benzothiazole-2-thione

  • 90723-35-6

    N-[diethylamino(methoxy)phosphoryl]-N-ethylethanamine

  • 38590-11-3

    N-[amino(diethylamino)phosphoryl]-N-ethylethanamine

  • 562-17-4

    N-[diethylamino(fluoro)phosphoryl]-N-ethylethanamine

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