丙烯醛-2,4-二硝基苯腙

丙烯醛-2,4-二硝基苯腙 基本信息
CAS号 888-54-0 分子式 C9H8N4O4
分子量 236.18400 精确质量 　236.05500
PSA 　116.03000 LogP 　3.20610
我要卖该产品 我要采购该产品
充值推广 查看更多供应商
目录
基本信息 物化性质 安全信息 合成路线 化学图谱 MSDS 海关数据 结构与计算数据 上下游

基本信息 展开↓

CAS号：
888-54-0
3D弹球模型：
立即前往扯扯看
分子式：
C9H8N4O4
分子量：
236.18400
中文名称：
丙烯醛-2,4-二硝基苯腙
英文名称：
Acrolein 2,4-Dinitrophenylhydrazone
中文别名：
丙烯醛-2,4-二硝基苯腙;
丙烯醛2,4-二硝基苯腙;
丙烯醛-2,4-DNPH;
2-丙烯醛 2-(2,4-二硝基苯基)腙;
2-丙烯醛2,4-二硝基苯腙
英文别名：
Acrolein 2,4-Dinitrophenylhydrazone;
ACROLEIN 2,4-DINITROPHENYLHYDRAZONE
精确分子量/精确质量：
236.05500
极性分子表面积/PSA：
116.03000
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：
MFCD00191599
BRN：
5343581
InChI：
InChI=1/C9H8N4O4/c1-2-5-10-11-8-4-3-7(12(14)15)6-9(8)13(16)17/h2-6,11H,1H2

物化性质展开↓

密度：
1.4g/cm3
熔点：
221-222ºC
沸点：
392.8ºC at 760 mmHg
闪点：
2ºC
折射率：
1.614
存储条件/存储方法：

 2-8°C密封储存

其它信息：

1.      性状：未确定

2.      密度（g/mL,25/4℃）：未确定

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）：2 °C

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：未确定

安全信息展开↓

海关代码：
2928000090
危险类别码：
36/37/38-36-20/21/22-11
安全说明：
26-36/37-16
安全标志：
S26:万一接触眼睛，立即使用大量清水冲洗并送医诊治。
S36:穿戴合适的防护服装。
危险标志：
Xi,Xn,F

合成路线查看所有的合成路线

  • 36986-33-1

    36986-33-1

  • +

  • 7647-01-0

    氯化氢

  • +

  • 119-26-6

    2,4-二硝基苯肼

  • →

  • 40365-04-6

    N-(2,4-dinitrophenyl)-N'-(3-hydroxypropylidene)-hydrazine

  • +

  • 888-54-0

    丙烯醛-2,4-二硝基苯腙

  • 7647-01-0

    氯化氢

  • +

  • 64-17-5

    乙醇

  • +

  • 500349-34-8

    500349-34-8

  • +

  • 119-26-6

    2,4-二硝基苯肼

  • →

  • 888-54-0

    丙烯醛-2,4-二硝基苯腙

  • 107-18-6

    烯丙醇

  • +

  • 119-26-6

    2,4-二硝基苯肼

  • →

  • 888-54-0

    丙烯醛-2,4-二硝基苯腙

化学图谱

  1. 丙烯醛-2,4-二硝基苯腙质谱(MS)

  2. 丙烯醛-2,4-二硝基苯腙核磁图(13CNMR)

  3. 丙烯醛-2,4-二硝基苯腙核磁图(1HNMR)

上一页 1/4 下一页

MSDS 展开↓

  Acrolein 2,4-Dinitrophenylhydrazone      Revision number: 6    
  SAFETY DATA SHEET
Section 1. IDENTIFICATION
  Product name:        Acrolein 2,4-Dinitrophenylhydrazone    
    
  Revision number:        6    
Section 2. HAZARDS IDENTIFICATION
  GHS classification
  PHYSICAL HAZARDS
    Category 2
  Flammable solids
  HEALTH HAZARDS
    Category 2
  Skin corrosion/irritation
  Serious eye damage/eye irritation        Category 2A    
    Not classified
  ENVIRONMENTAL HAZARDS
  GHS label elements, including precautionary statements
  Pictograms or hazard symbols
  Signal word        Warning    
  Hazard statements        Flammable solid    
    Causes skin irritation
    Causes serious eye irritation
  Precautionary statements:
    Keep away from heat/sparks/open flames/hot surfaces. - No smoking.
  [Prevention]
    Use explosion-proof electrical/ventilating/lighting equipment.
    Wash hands thoroughly after handling.
    Wear protective gloves/eye protection/face protection.
    IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses,
  [Response]
    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    
  Components:        Acrolein 2,4-Dinitrophenylhydrazone    
  Percent:        >98.0%(HPLC)(T)    
    888-54-0
  CAS Number:
  Synonyms:        2-Propenal 2,4-Dinitrophenylhydrazone    
  Chemical Formula:        C9H8N4O4    
  Acrolein 2,4-Dinitrophenylhydrazone
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.
  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:
  Specific hazards arising Explosion risk in case of fire. Fight fire remotely due to the risk of explosion.
  from the chemical:        Take care as it may decompose upon combustion or in high temperatures to    
    generate poisonous fume.
  Precautions for firefighters: 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: Keep containers cool by
    spraying with water. Eliminate all ignition sources 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
    Use personal protective equipment. Keep people away from and upwind of spill/leak.
  Personal precautions,
  protective equipment and Entry to non-involved personnel should be controlled around the leakage area by
  emergency procedures: roping off, etc.
  Environmental precautions: Prevent product from entering drains.
  Methods and materials for Sweep dust to collect it into an airtight container, taking care not to disperse it.
  containment and cleaning Adhered or collected material should be promptly disposed of, in accordance with
  up: appropriate laws and regulations.
  Prevention of secondary Remove all sources of ignition. Fire-extinguishing devices should be prepared in
  hazards:        case of a fire. Use spark-proof tools and explosion-proof equipment.    
Section 7. HANDLING AND STORAGE
  Precautions for safe handling
  Technical measures:        Handling is performed in a well ventilated place. Wear suitable protective equipment.    
    Be careful not to cause leakage, overflow, or dispersion. Steam should not be
    generated unnecessarily. Keep away from heat/sparks/open flame/hot surfaces. -No
    smoking. Take measures to prevent the build up of electrostatic charge. Use
    explosion-proof equipment. Avoid shock and friction. Wash hands and face before
    breaks and immediately after handling the product.
    Use a local exhaust if dust or aerosol will be generated.
  Advice on safe handling: Avoid contact with skin, eyes and clothing.
  Conditions for safe storage, including any
  incompatibilities
  Storage conditions:        Keep container tightly closed. Store in a cool and dark place.    
    Be sure not to give the container unexpected impacts, such as falling down or falling
    off.
    Store away from incompatible materials such as oxidizing agents.
  Packaging material:        Comply with laws.    
Section 8. EXPOSURE CONTROLS / PERSONAL PROTECTION
  Engineering controls:        Install a closed system or local exhaust. Also install safety shower and eye bath.    
  Personal protective equipment
  Acrolein 2,4-Dinitrophenylhydrazone
Section 8. EXPOSURE CONTROLS / PERSONAL PROTECTION
  Respiratory protection: Dust 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
  Physical state (20°C):        Solid    
  Form:        Crystal- Powder    
  Colour:        Yellow - Yellow red    
  Odour:        No data available    
  pH: No data available
  Melting point/freezing point:165°C
  Boiling point/range:        No data available    
  Flash point:        No data available    
  Flammability or explosive
  limits:
  Lower:        No data available    
  Upper:        No data available    
  Relative density:        No data available    
  Solubility(ies):
  [Water]        No data available    
  [Other solvents]        No data available    
Section 10. STABILITY AND REACTIVITY
  Chemical stability:        Stable under proper conditions.    
  Possibility of hazardous May explosively decompose on heating, shock, friction, etc.
  reactions:
    Heat, Spark, Open flame, Static discharge, Shock, Friction
  Conditions to avoid:
  Incompatible materials: Oxidizing agents
  Hazardous decomposition Carbon monoxide, Carbon dioxide, Nitrogen oxides (NOx)
  products:
Section 11. TOXICOLOGICAL INFORMATION
  Acute Toxicity:        No data available    
  Skin corrosion/irritation: No data available
  Serious eye        No data available    
  damage/irritation:
  Germ cell mutagenicity: No data available
  Carcinogenicity:
  IARC =        No data available    
  NTP =        No data available    
  Reproductive toxicity:        No data available    
Section 12. ECOLOGICAL INFORMATION
  Ecotoxicity:
  Fish:        No data available    
    No data available
  Crustacea:
  Algae:        No data available    
  Persistence / degradability: No data available
  Bioaccumulative        No data available    
  potential(BCF):
  Mobility in soil
    No data available
  Log Pow:
  Soil adsorption (Koc):        No data available    
    No data available
  Henry's Law
  constant(PaM3/mol):
  Acrolein 2,4-Dinitrophenylhydrazone
Section 13. DISPOSAL CONSIDERATIONS
    Recycle to process, if possible. Consult your local regional authorities and an expert of disposal. You may be able
    to dissolve or mix material with a combustible solvent and little by little burn in a chemical incinerator equipped with
    an afterburner and scrubber system. If a large amount of the substance is burned at a time, an explosion may
    occur. Observe all federal, state and local regulations when disposing of the substance.
Section 14. TRANSPORT INFORMATION
  Hazards Class:        4.1: Flammable solid.    
    1325
  UN-No:
  Proper shipping name:        Flammable solid, organic, n.o.s.    
    III
  Packing group:
Section 15. REGULATORY INFORMATION
  Safe management ordinance of dangerous chemical product (State Council announces on January 26, 2002
  and revised on February 16,2011): 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：2928000090

概述：
2928000090 其他肼（联氨）及胲（羟胺）的有机衍生物。监管条件:无。增值税率:17.0%。退税率:9.0%。最惠国关税:6.5%。普通关税:20.0%
申报要素：
品名, 成分含量, 用途
摘要/Summary：
2928000090 other organic derivatives of hydrazine or of hydroxylamine VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

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：58.71

2、   摩尔体积（m3/mol）：168.3

3、   等张比容（90.2K）：469.9

4、   表面张力（dyne/cm）：60.7

5、   极化率（10-24cm3）：23.27

计算化学数据

1、   疏水参数计算参考值（XlogP）：1.4

2、   氢键供体数量：1

3、   氢键受体数量：6

4、   可旋转化学键数量：3

5、   拓扑分子极性表面积（TPSA）：111

6、   重原子数量：17

7、   表面电荷：0

8、   复杂度：333

9、   同位素原子数量：0

10、   确定原子立构中心数量：0

11、   不确定原子立构中心数量：0

12、   确定化学键立构中心数量：1

13、   不确定化学键立构中心数量：0

14、   共价键单元数量：1

上下游相关产品

上游产品

更多

  • 500349-34-8

    N/A

  • 119-26-6

    2,4-二硝基苯肼

  • 93734-97-5

    N-[3-(benzenesulfonyl)propylideneamino]-2,4-dinitroaniline

  • 107-02-8

    丙烯醛

  • 40964-63-4

    1-phenyl-4-penten-1-yn-3-ol

立即下载安装“化学加”APP
专业、功能强大，随时调用更加方便
下载APP