3032-92-6 (4-乙炔基苯甲腈,4-Ethynylbenzonitrile)

CAS号:
3032-92-6
中文名称:
4-乙炔基苯甲腈
英文名称:
4-Ethynylbenzonitrile
安全信息:
分子式:
C9H5N
分子量:
127.142701864243

4-乙炔基苯甲腈(3032-92-6)名称与标识符

名称

中文别名:
4-乙炔基苯甲腈;4-乙基苯甲腈;4-乙基苯腈;4-乙炔苯腈;4-乙炔基苯甲腈,4-Ethynylbenzonitrile;4-乙炔基苯腈;
英文别名:
4-Ethynylbenzonitrile;4-ETHYNYLBENZONITRILE 97;Benzonitrile,4-ethynyl-;(4-cyanophenyl)ethyne;4-(1-ethynyl)benzonitrile;4-cyanophenylacetylene;4-ethynylbenzenecarbonitrile;4-Ethynyl-benzonitrile;Benzonitrile,4-ethynyl;p-cyanophenylacetylene;1-Cyano-4-ethynylbenzene;CS-W007419;MFCD04974058;DTXSID20404122;SCHEMBL853731;AC-18651;4-cyano phenylacetylene;4-ETHYNYLBENZONITRILE 97;4-Ethynylbenzonitrile, 97%;AKOS015836148;SY021679;BCP18853;4-Ethynyl-Bezonitrile;GS-4324;doi:10.14272/LAGNMUUUMQJXBF-UHFFFAOYSA-N.1;3032-92-6;J-017912;Benzonitrile, 4-ethynyl-;A820324;LAGNMUUUMQJXBF-UHFFFAOYSA-N;Z1069202674;4-ETHYNYLBENZONITRILE97;EN300-110379;AM20060603;FT-0659453;DB-011339;

标识符

MDL:
MFCD04974058
InChIKey:
LAGNMUUUMQJXBF-UHFFFAOYSA-N
Inchi:
1S/C9H5N/c1-2-8-3-5-9(7-10)6-4-8/h1,3-6H
SMILES:
N#CC1C=CC(C#C)=CC=1

4-乙炔基苯甲腈(3032-92-6)物化性质

实验特性

  • LogP : 1.53958
  • PSA : 23.79000
  • 折射率 : 1.566
  • 水溶性 : Slightly soluble in water.
  • 沸点 : 230.2±23.0 ºC (760 Torr),
  • 熔点 : 156-160 °C (lit.)
  • 闪点 : 92.9±15.1 ºC,
  • 溶解度 : Very 微溶 (0.67 g/L) (25 ºC),
  • 颜色与性状 : 未确定
  • 溶解性 : 未确定
  • 密度 : 1.08±0.1 g/cm3 (20 ºC 760 Torr),

计算特性

  • 精确分子量 : 127.04200
  • 氢键供体数量 : 0
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 0
  • 同位素质量 : 127.042
  • 重原子数量 : 10
  • 复杂度 : 191
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 1.9
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 23.8A^2

4-乙炔基苯甲腈(3032-92-6)海关数据

海关编码:
2926909090
海关数据:

中国海关编码:

2926909090

概述:

2926909090 其他腈基化合物. 增值税率:17.0% 退税率:9.0% 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

Summary:

HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

4-乙炔基苯甲腈(3032-92-6)推荐厂家 更多厂家(31)

公司名称手机号/电话联系人QQ微信询单
上海吉至生化科技有限公司 18117592386
021-57481218
吉至试剂 3007522982
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湖北方德新材料有限公司 18086096695邱经理 1462312301
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上海瀚思化工有限公司 18939883912
021-34536277
顾经理 3003949364
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上海腾准生物科技有限公司 19821570922
021-34053661
张经理 3003871136
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上海绩祥生物科技有限公司 13093077543陆经理 3985448220
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上海一基实业有限公司 13311756052
021-60526763 13311756052 13311756131
胡经理 2355265332
询单
上海一基实业有限公司 13311756131
021-60548336 QQ:2355265332 QQ:2851717387
胡经理 2355265332
询单
南通众合化工新材料有限公司 18762756250
0513-55074056
胡经理 2369399482
询单
南通众合化工新材料有限公司 18762756250
0513-55074056
胡经理 2369399482
询单
湖北垚烁泉化工有限公司 18971203904黄经理 1601302530
询单

4-乙炔基苯甲腈(3032-92-6)相关文献

4-乙炔基苯甲腈(3032-92-6) MSDS

基础信息

  Material Safety Data Sheet

Section 1. Identi?cation of the substance
    Product Name:      4-Ethynylbenzonitrile    
    Synonyms:

Section 2. Hazards identi?cation
    Harmful by inhalation, in contact with skin, and if swallowed.
    H315:        Causes skin irritation    
    H319:        Causes serious eye irritation    
    H335:        May cause respiratory irritation    
    P261:        Avoid breathing dust/fume/gas/mist/vapours/spray    
    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:        4-Ethynylbenzonitrile    
    CAS number:        3032-92-6    

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.
    Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate
    Eye contact:
    ?ushing of the eyes by separating the eyelids with ?ngers. 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 ?ghting measures
    In the event of a ?re 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 quali?ed    
    in the handling and use of potentially hazardous chemicals, who should take into account the ?re,
    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
    Appearance:        Not speci?ed    
    No data
    Boiling point:
    Melting point:        No data    
    Flash point:        No data    
    Density:        No data    
    Molecular formula: C9H5N
    Molecular weight: 127.1

Section 10. Stability and reactivity
    Conditions to avoid: Heat, ?ames 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:        UN3439        Class: 6.1        Packing group: III    
    Proper shipping name: NITRILES, TOXIC, SOLID, N.O.S. (4-Ethynylbenzonitrile)

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