3-[1-(二甲氨基)乙基]苯酚

3-[1-(二甲氨基)乙基]苯酚 基本信息
CAS号 105601-04-5 分子式 C10H15NO
分子量 165.23200 精确质量  165.11500
PSA  23.47000 LogP  2.01480

基本信息 展开↓

CAS号:
105601-04-5
3D弹球模型:
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分子式:
C10H15NO
分子量:
165.23200
中文名称:
3-[1-(二甲氨基)乙基]苯酚
英文名称:
3-[1-(Dimethylamino)ethyl]phenol
中文别名:
3-[1-(二甲氨基)乙基]苯酚;
3-[1-(二甲基氨基)乙基]苯酚
英文别名:
3-[1-(Dimethylamino)ethyl]phenol;
3-[1-(dimethylamino)ethyl]phenol
精确分子量/精确质量:
165.11500
极性分子表面积/PSA:
23.47000
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:
InChI=1/C10H15NO/c1-8(11(2)3)9-5-4-6-10(12)7-9/h4-8,12H,1-3H3/t8-/m1/s1

生产制备方法及用途展开↓

制备方法


卡巴拉汀中间体。

用途简介


物化性质展开↓

外观与性状:
淡棕色固体
密度:
1.021 g/cm3
熔点:
87-89°C
沸点:
241.3ºCat 760 mmHg
闪点:
97.2ºC
折射率:
1.539
蒸汽压:
0.0233mmHg at 25°C

合成路线查看所有的合成路线

  • 923035-06-7

    3-[1-(methylamino)ethyl]phenol

  • ~85%

  • 105601-04-5

    3-[1-(二甲氨基)乙基]苯酚

  • 50-00-0

    甲醛

  • +

  • 923035-06-7

    3-[1-(methylamino)ethyl]phenol

  • ~85%

  • 105601-04-5

    3-[1-(二甲氨基)乙基]苯酚

  • 50-00-0

    甲醛

  • +

  • 63720-38-7

    3-(1-氨基乙基)苯酚

  • ~83%

  • 105601-04-5

    3-[1-(二甲氨基)乙基]苯酚

MSDS 展开↓

  Material Safety Data Sheet

Section 1. Identification of the substance
    Product Name:      3-[1-(Dimethylamino)ethyl]phenol    
    Synonyms:

Section 2. Hazards identification
    Harmful by inhalation, in contact with skin, and if swallowed.
    H301:        Toxic if swallowed    
    H318:        Causes serious eye damage    
    H412:        Harmful to aquatic life with long lasting effects    
    P273:        Avoid release to the environment    
    P280:        Wear protective gloves/protective clothing/eye protection/face protection    
    P301+P310:        IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician    
    P305+P351+P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present
    and easy to do – continue rinsing

Section 3. Composition/information on ingredients.
    Ingredient name:        3-[1-(Dimethylamino)ethyl]phenol    
    CAS number:        105601-04-5    

Section 4. First aid measures
    Skin contact:        Immediately wash skin with copious amounts of water for at least 15 minutes while removing    
    contaminated clothing and shoes. If irritation persists, seek medical attention.
    Eye contact:        Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate    
    flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical
    attention.
    Inhalation:        Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.    
    Ingestion:        Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.    

Section 5. Fire fighting measures
    In the event of a fire involving this material, alone or in combination with other materials, use dry
    powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
    should be worn.

Section 6. Accidental release measures
    Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
    standards.
    Respiratory precaution:        Wear approved mask/respirator    
    Hand precaution:        Wear suitable gloves/gauntlets    
    Skin protection:        Wear suitable protective clothing    
    Eye protection:        Wear suitable eye protection    
    Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
    for disposal. See section 12.
    Environmental precautions: Do not allow material to enter drains or water courses.

Section 7. Handling and storage
    Handling:        This product should be handled only by, or under the close supervision of, those properly qualified    
    in the handling and use of potentially hazardous chemicals, who should take into account the fire,
    health and chemical hazard data given on this sheet.
    Storage:        Store in closed vessels.    

Section 8. Exposure Controls / Personal protection
    Engineering Controls: Use only in a chemical fume hood.
    Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
    General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

Section 9. Physical and chemical properties
    Not specified
    Appearance:
    Boiling point:        No data    
    Melting point:        No data    
    Flash point:        No data    
    Density:        No data    
    Molecular formula:        C10H15NO    
    Molecular weight:        165.2    

Section 10. Stability and reactivity
    Conditions to avoid: Heat, flames and sparks.
    Materials to avoid: Oxidizing agents.
    Possible hazardous combustion products: Carbon monoxide, nitrogen oxides.

Section 11. Toxicological information
    No data.

Section 12. Ecological information
    No data.

Section 13. Disposal consideration
    Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
    disposal authority, in accordance with national and regional regulations.

Section 14. Transportation information
    UN Number:        UN2811 Class: 6.1 Packing group: III    
    Proper shipping name: TOXIC SOLIDS, ORGANIC, N.O.S. (3-[1-(Dimethylamino)ethyl]phenol)

Section 15. Regulatory information
    No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
    302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
    Title III, Section 313.


SECTION 16 - ADDITIONAL INFORMATION
N/A

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