1-吡啶-3-基乙酮肟

1-吡啶-3-基乙酮肟 基本信息
CAS号 5973-83-1 分子式 C7H8N2O
分子量 136.15100 精确质量 　136.06400
PSA 　45.48000 LogP 　1.27980
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目录
基本信息 物化性质 安全信息 合成路线 毒性 MSDS 上下游

基本信息 展开↓

CAS号：
5973-83-1
3D弹球模型：
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分子式：
C7H8N2O
分子量：
136.15100
中文名称：
1-吡啶-3-基乙酮肟
英文名称：
1-(3-PYRIDYL)ETHAN-1-ONE OXIME
中文别名：
1-吡啶-3-基乙酮肟;
1-(3-吡啶)-1-乙酮肟;
3-吡啶基甲基酮肟;
1-(3-吡啶L)乙-1-酮肟
英文别名：
1-(3-PYRIDYL)ETHAN-1-ONE OXIME;
ketone,methyl3-pyridyl,oxime;
Methyl pyridin-3-yl ketoxime;
Methyl 3-pyridyl ketoxiMe;
3-acetylpyridineoxime
精确分子量/精确质量：
136.06400
极性分子表面积/PSA：
45.48000
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: MSRXORUOQNNOKN-UHFFFAOYSA-N

物化性质展开↓

密度：
1.11 g/cm3
熔点：
103ºC
沸点：
277.1ºC at 760 mmHg
闪点：
121.4ºC
折射率：
1.55

安全信息展开↓

危险标志：
Xn: Harmful;

合成路线查看所有的合成路线

  • 350-03-8

    3-乙酰基吡啶

  • →

    ~95%

  • 5973-83-1

    1-吡啶-3-基乙酮肟

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
OB5600000
CHEMICAL NAME :
Ketone, methyl 3-pyridyl, oxime
CAS REGISTRY NUMBER :
5973-83-1
BEILSTEIN REFERENCE NO. :
0114168
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H8-N2-O
MOLECULAR WEIGHT :
136.17
WISWESSER LINE NOTATION :
T6NJ CY1&UNQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1480 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 7,690,1955

MSDS 展开↓

  Material Safety Data Sheet
Section 1. Identification of the substance
    Product Name:      1-Pyridin-3-yl-ethanone oxime    
    Synonyms:
Section 2. Hazards identification
    Harmful by inhalation, in contact with skin, and if swallowed.
Section 3. Composition/information on ingredients.
    Ingredient name:        1-Pyridin-3-yl-ethanone oxime    
    CAS number:        5973-83-1    
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.
    Store in closed vessels.
    Storage:
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
    Appearance:        Not specified    
    Boiling point:        No data    
    No data
    Melting point:
    Flash point:        No data    
    Density:        No data    
    Molecular formula:        C7H8N2O    
    Molecular weight:        136.2    
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
    Non-harzardous for air and ground transportation.
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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