1,2-二(2-苄氨基乙氧基)乙烷

1,2-二(2-苄氨基乙氧基)乙烷 基本信息
CAS号 66582-26-1 分子式 C20H28N2O2
分子量 328.44900 精确质量 　328.21500
PSA 　42.52000 LogP 　3.38100
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目录
基本信息 物化性质 安全信息 合成路线 MSDS 海关数据 结构与计算数据 上下游

基本信息 展开↓

CAS号：
66582-26-1
3D弹球模型：
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分子式：
C20H28N2O2
分子量：
328.44900
中文名称：
1,2-二(2-苄氨基乙氧基)乙烷
英文名称：
1,2-Bis(2-benzylaminoethoxy)ethane
中文别名：
1,2-二(2-苄氨基乙氧基)乙烷;
1,10-二苄基-4,7-二氧杂-1,10-二氮杂癸烷;
1,2-双(2-苄胺乙氧基)乙烷;
乙二醇双(2-苄基氨乙基)醚;
1,2-双(2-苄氨基乙氧基)乙烷
英文别名：
1,2-Bis(2-benzylaminoethoxy)ethane;
N-benzyl-2-[2-[2-(benzylamino)ethoxy]ethoxy]ethanamine
精确分子量/精确质量：
328.21500
极性分子表面积/PSA：
42.52000
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：
MFCD00191390
InChI：
The Key: FQEGBHFZAGTXDY-UHFFFAOYSA-N

物化性质展开↓

密度：
1.05
沸点：
451.263ºC at 760 mmHg
闪点：
196.68ºC
折射率：
1.545
存储条件/存储方法：

存放在密封容器内，并放在阴凉，干燥处。储存的地方必须远离氧化剂，避光，室温保存。

稳定性相关：

远离氧化物，阳光，热，明火，高温，火花，静电电荷，其他点火源。

其它信息：

1.       性状：无色或者浅黄色液体。

2.       密度（g/mL,25/4℃）：1.05

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,常压）：未确定

6.       沸点（ºC,5.2kPa）：未确定

7.       折射率：未确定

8.       闪点（ºC）：未确定

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：几乎不溶于水，与乙醇，丙酮混溶。

安全信息展开↓

海关代码：
2922199090

合成路线查看所有的合成路线

  • 112-26-5

    1,2-二(2-氯乙氧基)乙烷

  • +

  • 100-46-9

    苯甲胺

  • →

    ~98%

  • 66582-26-1

    1,2-二(2-苄氨基乙氧基)乙烷

  • 36839-55-1

    1,2-双(2-碘乙氧基)乙烷

  • +

  • 100-46-9

    苯甲胺

  • →

    ~88%

  • 66582-26-1

    1,2-二(2-苄氨基乙氧基)乙烷

  • 929-59-9

    1,8-二氨基-3,6-二氧杂辛烷

  • +

  • 100-52-7

    苯甲醛

  • →

    ~77%

  • 66582-26-1

    1,2-二(2-苄氨基乙氧基)乙烷

MSDS 展开↓

  1,2-Bis(2-benzylaminoethoxy)ethane
  SAFETY DATA SHEET
Section 1. IDENTIFICATION OF THE SUBSTANCE OR MIXTURE AND OF THE SUPPLIER
  Product name:        1,2-Bis(2-benzylaminoethoxy)ethane    
Section 2. HAZARDS IDENTIFICATION
  Classification of the GHS
  PHYSICAL HAZARDS        Not classified    
  HEALTH HAZARDS
    Category 2
  Skin corrosion/irritation
  Serious eye damage/eye irritation        Category 2A    
    Not classified
  ENVIRONMENTAL HAZARDS
  GHS label elements
  Pictograms or hazard symbols
  Signal word        Warning    
  Hazard statement        Causes skin irritation    
    Causes serious eye irritation
  Precautionary statements
  [Prevention]        Wash hands thoroughly after handling.    
    Wear protective gloves/eye protection/face protection.
  [Response]        IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses,    
    if present and easy to do. Continue rinsing.
    If eye irritation persists: Get medical advice/attention.
    IF ON SKIN: Gently wash with plenty of soap and water.
    If skin irritation occurs: Get medical advice/attention.
    Take off contaminated clothing and wash before reuse.
Section 3. COMPOSITION/INFORMATION ON INGREDIENTS
  Substance/mixture:        Substance    
  Component(s):        1,2-Bis(2-benzylaminoethoxy)ethane    
  Percent:        >90.0%(GC)    
  CAS Number:        66582-26-1    
  Synonyms:        1,10-Dibenzyl-4,7-dioxa-1,10-diazadecane , Ethylene Glycol Bis(2-benzylaminoethyl)    
    Ether
    C20H28N2O2
  Chemical Formula:
Section 4. FIRST AID MEASURES
  Inhalation:        Remove victim to fresh air and keep at rest in a position comfortable for breathing.    
    Get medical advice/attention if you feel unwell.
  1,2-Bis(2-benzylaminoethoxy)ethane
Section 4. FIRST AID MEASURES
  Skin contact:        Remove/Take off immediately all contaminated clothing. Gently wash with plenty of    
    soap and water. If skin irritation or rash occurs: Get medical advice/attention.
  Eye contact:        Rinse cautiously with water for several minutes. Remove contact lenses, if present    
    and easy to do. Continue rinsing. If eye irritation persists: Get medical
    advice/attention.
  Ingestion:        Get medical advice/attention if you feel unwell. Rinse mouth.    
    A rescuer should wear personal protective equipment, such as rubber gloves and air-
  Protection of first-aiders:
    tight goggles.
Section 5. FIRE-FIGHTING MEASURES
  Suitable extinguishing        Dry chemical, foam, water spray, carbon dioxide.    
  media:
  Extinguishing media not to Solid streams of water
  be used:
  Specific hazards:        Take care as it may decompose upon combustion or in high temperatures to    
    generate poisonous fume.
  Specific methods:        Fire-extinguishing work is done from the windward and the suitable fire-extinguishing    
    method according to the surrounding situation is used. Uninvolved persons should
    evacuate to a safe place. In case of fire in the surroundings: Remove movable
    containers if safe to do so.
  Special protective        When extinguishing fire, be sure to wear personal protective equipment.    
  equipment for firefighters:
Section 6. ACCIDENTAL RELEASE MEASURES
  Personal precautions,        Use personal protective equipment. Keep people away from and upwind of spill/leak.    
  protective equipment and Ensure adequate ventilation. Entry to non-involved personnel should be controlled
  emergency procedures: around the leakage area by roping off, etc.
  Environmental precautions: Prevent product from entering drains.
  Methods and materials for Absorb spilled material in a suitable absorbent (e.g. rag, dry sand, earth, saw-dust).
  containment and cleaning In case of large amount of spillage, contain a spill by bunding. Adhered or collected
  up: material should be promptly disposed of, in accordance with appropriate laws and
    regulations.
Section 7. HANDLING AND STORAGE
  Handling
  Technical measures:        Handling is performed in a well ventilated place. Wear suitable protective equipment.    
    Prevent generation of vapor or mist. Wash hands and face thoroughly after handling.
    Use a ventilation, local exhaust if vapor or aerosol will be generated.
  Advice on safe handling:        Avoid contact with skin, eyes and clothing.    
  Storage
  Storage conditions:        Keep container tightly closed. Store in a cool and dark place.    
    Store away from incompatible materials such as oxidizing agents.
  Packaging material:        Law is followed.    
Section 8. EXPOSURE CONTROLS / PERSONAL PROTECTION
  Engineering controls:        Install a closed system or local exhaust as possible so that workers should not be    
    exposed directly. Also install safety shower and eye bath.
  Personal protective equipment
  Respiratory protection: Vapor respirator. Follow local and national regulations.
  Hand protection:        Protective gloves.    
  Eye protection:        Safety glasses. A face-shield, if the situation requires.    
  Skin and body protection: Protective clothing. Protective boots, if the situation requires.
Section 9. PHYSICAL AND CHEMICAL PROPERTIES
    Liquid
  Physical state (20°C):
  Form:        clear    
  1,2-Bis(2-benzylaminoethoxy)ethane
Section 9. PHYSICAL AND CHEMICAL PROPERTIES
  Color:        Pale yellow - Yellow green    
  Odor:        No data available    
  pH: No data available
  Melting point/freezing point:No data available
  Boiling Point/Range:        No data available    
  Flash Point:        No data available    
  Explosive limits
    No data available
  Lower:
  Upper:        No data available    
    1.05
  Density:
  Solubility:        No data available    
Section 10. STABILITY AND REACTIVITY
  Stability:        Stable under proper conditions.    
  Reactivity:        No special reactivity has been reported.    
  Incompartible materials: oxidizing agents
  Hazardous Decomposition Carbon monoxide, Carbon dioxide, Nitrogen oxides (NOx)
  Products:
Section 11. TOXICOLOGICAL INFORMATION
    No data available
  Acute Toxicity:
  Skin corrosion/irritation: No data available
  Serious eye        No data available    
  damage/irritation:
  Germ cell mutagenicity: No data available
  Carcinogenicity:
    No data available
  IARC =
  NTP =        No data available    
    No data available
  Reproductive toxicity:
Section 12. ECOLOGICAL INFORMATION
  Ecotoxicity:
  Fish:        No data available    
  Crustacea:        No data available    
  Algae:        No data available    
  Persistence / degradability: No data available
  Bioaccumulative        No data available    
  potential(BCF):
  Mobillity in soil
  log Pow:        No data available    
  Soil adsorption (Koc):        No data available    
  Henry's Law        No data available    
  constant(PaM3/mol):
Section 13. DISPOSAL CONSIDERATIONS
    Recycle to process, if possible. Consult your local regional authorities. You may be able to burn in a chemical
    incinerator equipped with an afterburner and scrubber system. Observe all federal, state and local regulations when
    disposing of the substance.
Section 14. TRANSPORT INFORMATION
  Hazards Class:        Does not correspond to the classification standard of the United Nations    
  UN-No:        Not Listed    
  1,2-Bis(2-benzylaminoethoxy)ethane
Section 15. REGULATORY INFORMATION
  Safe management ordinance of dangerous chemical product (State Council announces on January 26,
  2002): Safe use and production, the storage of a dangerous chemical, transport, loading and unloading were
    prescribed.

SECTION 16 - ADDITIONAL INFORMATION
N/A

海关数据查看详细

中国海关编码：2922199090

概述：
2922199090. 其他氨基醇及其醚，酯和它们的盐（但含一种以上含氧基的除外）. 增值税率:17.0%. 退税率:13.0%. 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, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
摘要/Summary：
2922199090. other amino-alcohols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

分子结构与计算化学数据展开↓

分子结构数据

1、   摩尔折射率：98.76

2、   摩尔体积（m3/mol）：312.3

3、   等张比容（90.2K）：789.9

4、   表面张力（dyne/cm）：40.9

5、   极化率（10-24cm3）：39.15

计算化学数据

1.疏水参数计算参考值（XlogP）:2.1

2.氢键供体数量:2

3.氢键受体数量:4

4.可旋转化学键数量:13

5.互变异构体数量:无

6.拓扑分子极性表面积42.5

7.重原子数量:24

8.表面电荷:0

9.复杂度:249

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

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  • 929-59-9

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  • 100-46-9

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  • 36839-55-1

    1,2-双(2-碘乙氧基)乙烷

下游产品

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