2-异丙基萘

  • 基本信息
  • 制备方法及用途
  • 物化性质
  • 安全信息
  • 毒理性
  • MSDS
  • 海关数据
  • 结构与计算化学
  • 上游产品
  • 下游产品
  • 表征图谱

2-异丙基萘 基本信息

中文名称:
2-异丙基萘 
中文别名:
2-异丙基萘;
(S)-2-Amino-3-methyl-butanol;
(S)-(+)-2-Amino-3-methyl-1-butanol;
H-Val-ol;
Valinol,97%;
L-Valinol;
(2R)-2-amino-3-methylbutan-1-ol;
6-amino-5-fluoropyrimidin-2(1H)-one;
4-amino-1-fluoropyrimidin-2(1H)-one;
5-fluoro cytosine;
5-fluorocystosine;
4-Amino-5-fluoro-2(1H)-pyrmidinone;
Flucylosine;
Fluorocytosine;
4-Chloro-A-(1-Methylethyl) Benzene Acetonitrile;
2,4-DDimethylamine;
2,4-ddimethylaminesalt[qr];
2,4-ddma;
(2,4-dichloroph 
英文名称:
2-isopropylnaphthalene
英文别名:
2-ISOPROPYLNAPHTHALENE;
5-hydroxy-2-iso-propyl-pyrimidine;
2-iso-propylnaphthalene;
ISOPROPYLNAPHTHALENE;
2-isopropylnapthalene;
2-isopropyl-pyrimidin-5-ol;
5-Hydroxy-2-isopropylpyrimidin;
2-Isopropyl-5-hydroxypyrimidin;
2-isopropyl-5-hydroxy-pyrimidine 
CAS No.:
2027-17-0
分 子 式:

C13H14

分 子 量:
170.26
精确分子量:
170.11000
PSA:
0.00000
MDL:
MFCD00014322
EINECS:
217-976-0
BRN:
1099059
InChI:
InChI=1/C13H14/c1-10(2)12-8-7-11-5-3-4-6-13(11)9-12/h3-10H,1-2H3
危险品标志:

 

风险术语:

 

安全术语:

 

分子结构式:
SDS:
查看

2-异丙基萘 制备方法及用途

合成制备方法

1. 烟草:OR,57。

2-异丙基萘 物化性质

密度:
0,9753 g/cm3
熔点:
14°C
沸点:
261-263°C
闪点:
268°C
折射率:
1.5870
蒸汽压:
0.0129mmHg at 25°C
存储条件/存储方法:

保持贮藏器密封、储存在阴凉、干燥的地方,确保工作间有良好的通风或排气装置

 

稳定性相关:

1. 如果遵照规格使用和储存则不会分解,未有已知危险反应,避免氧化物

2. 存在于香料烟烟叶中。

        

其它信息:

1.       性状:液体

2.       密度(g/mL,25ºC):0.975

3.       相对密度(20℃,4℃):0.9762

4.       熔点(ºC):14.5

5.       沸点(ºC):268

6.       相对密度(25℃,4℃):0.9727

7.       折射率(n20D) :1.5848

8.       闪点(°C):268

9.       常温折射率(n20):1.5861

10.    常温折射率(n25):1.5839

11.    蒸气压(kPa,20ºC):未确定

12.    饱和蒸气压(kPa,25ºC):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:难溶解于水的

2-异丙基萘 安全信息

海关代码:
2902909090
RTECS号:
QJ8000000

2-异丙基萘 毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QJ8000000
CHEMICAL NAME :
Naphthalene, 2-isopropyl-
CAS REGISTRY NUMBER :
2027-17-0
BEILSTEIN REFERENCE NO. :
1099059
LAST UPDATED :
199701
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C13-H14

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
5300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,50,1986
毒理学数据:

1、急性毒性:小鼠经口LD50:5300mg/kg;

生态数据:

对水是稍微有危害的不要让未稀释或大量的产品接触地下水、水道或者污水系统,若无政府许可,勿将材料排入周围环境。

2-异丙基萘 MSDS


Section I.Chemical Product and Company Identification
    Chemical Name 2-Isopropylnaphthalene (beta-)
    Portland OR
    Synonym        Not available.    
    Chemical Formula        C10H7CH(CH3)2    
    CAS Number        2027-17-0    

Section II.        Composition and Information on Ingredients    
    Chemical Name        CAS Number Percent (%)        TLV/PEL        Toxicology Data    
    2-Isopropylnaphthalene (beta-)        2027-17-0        Min. 94.0 Not available.        Mouse LD50 (oral) 5300 mg/kg    
    (GC)

Section III. Hazards Identification
    Acute Health Effects        No specific information is available in our data base regarding the toxic effects of this material for humans. However,    
    exposure to any chemical should be kept to a minimum. Skin and eye contact may result in irritation. May be harmful if
    inhaled or ingested. Always follow safe industrial hygiene practices and wear proper protective equipment when handling
    this compound.
    CARCINOGENIC EFFECTS : Not available.
    Chronic Health Effects
    MUTAGENIC EFFECTS : Not available.
    TERATOGENIC EFFECTS : Not available.
    Toxicity to the reproductive system: Not available.
    There is no known effect from chronic exposure to this product. Repeated or prolonged exposure to this compound is
    not known to aggravate existing medical conditions.

Section IV.        First Aid Measures    
    Eye Contact        Check for and remove any contact lenses. DO NOT use an eye ointment. Flush eyes with running water for a minimum    
    of 15 minutes, occasionally lifting the upper and lower eyelids. Seek medical attention. Treat symptomatically and
    supportively.
    Skin Contact        If the chemical gets spilled on a clothed portion of the body, remove the contaminated clothes as quickly as possible,    
    protecting your own hands and body. Place the victim under a deluge shower. If the chemical touches the victim's
    exposed skin, such as the hands: Gently and thoroughly wash the contaminated skin with running water and non-abrasive
    soap. Be particularly careful to clean folds, crevices, creases and groin. Cover the irritated skin with an emollient. Seek
    medical attention. Treat symptomatically and supportively. Wash any contaminated clothing before reusing.
    Inhalation        If the victim is not breathing, perform artificial respiration. Loosen tight clothing such as a collar, tie, belt or waistband. If    
    breathing is difficult, oxygen can be administered. Seek medical attention. Treat symptomatically and supportively.
    Remove dentures if any. Have conscious person drink several glasses of water or milk. INDUCE VOMITING by sticking
    Ingestion
    finger in throat. Lower the head so that the vomit will not reenter the mouth and throat. NEVER give an unconscious
    person anything to ingest. Seek medical attention. Treat symptomatically and supportively.

Section V. Fire and Explosion Data
    Not available.
    Flammability        Combustible.        Auto-Ignition    
    Flammable Limits
    Flash Points        Not available.    
    122°C (251.6°F)
    Combustion Products        These products are toxic carbon oxides (CO, CO 2).    
    Fire Hazards
    No specific information is available regarding the flammability of this compound in the presence of various materials.
    Explosion Hazards        Risks of explosion of the product in presence of mechanical impact: Not available.    
    Risks of explosion of the product in presence of static discharge: Not available.
    No additional information is available regarding the risks of explosion.
    Fire Fighting Media
    SMALL FIRE: Use DRY chemicals, CO 2, water spray or foam.
    LARGE FIRE: Use water spray, fog or foam. DO NOT use water jet.
    and Instructions
    Continued on Next Page
    2-Isopropylnaphthalene (beta-)

Section VI.        Accidental Release Measures    
    Spill Cleanup        Combustible material.    
    Instructions        Keep away from heat and sources of ignition. Mechanical exhaust required. Stop leak if without risk. Finish cleaning the    
    spill by rinsing any contaminated surfaces with copious amounts of water.

Section VII. Handling and Storage
    Keep away from heat and sources of ignition. Mechanical exhaust required. When not in use, tightly seal the container
    Handling and Storage
    and store in a dry, cool place. Avoid excessive heat and light. Do not breathe gas, fumes, vapor or spray. In case of
    Information
    insufficient ventilation, wear suitable respiratory equipment. If you feel unwell, seek medical attention and show the label
    when possible. Treat symptomatically and supportively. Avoid contact with skin and eyes.
    Always store away from incompatible compounds such as oxidizing agents.

Section VIII. Exposure Controls/Personal Protection
    Engineering Controls        Provide exhaust ventilation or other engineering controls to keep the airborne concentrations of vapors below their    
    respective threshold limit value. Ensure that eyewash station and safety shower is proximal to the work-station location.
    Personal Protection        Splash goggles. Lab coat. Vapor respirator. Boots. Gloves. A MSHA/NIOSH approved respirator must be used to avoid    
    inhalation of the product. Suggested protective clothing might not be sufficient; consult a specialist BEFORE handling
    this product.
    Exposure Limits        Not available.    

Section IX. Physical and Chemical Properties
    Physical state @ 20°C        Clear, yellowish-brown liquid.        Solubility    
    Insoluble in cold water, hot water.
    0.973 (water=1)
    Specific Gravity
    Molecular Weight        170.25        Partition Coefficient    
    log Kow = 4.89
    Boiling Point        268°C (514.4°F)        Vapor Pressure        100 mm of Hg (@ 188.8°C)    
    Melting Point        -16°C (3.2°F)        Vapor Density        Not available.    
    Not available.        100% (v/v).    
    Refractive Index        Volatility    
    Critical Temperature        Not available.        Odor        Sweetish. (Slight.)    
    Viscosity        Not available.        Taste        Not available.    

Section X.        Stability and Reactivity Data    
    Stability    
This material is stable if stored under proper conditions. (See Section VII for instructions)    
    Conditions of Instability
    Avoid excessive heat and light.
    Incompatibilities
    Reactive with strong oxidizing agents.

Section XI. Toxicological Information
    RTECS Number        QJ8000000    
    Routes of Exposure        Ingestion. Inhalation.    
    Mouse LD50 (oral) 5300 mg/kg
    Toxicity Data
    CARCINOGENIC EFFECTS : Not available.
    Chronic Toxic Effects
    MUTAGENIC EFFECTS : Not available.
    TERATOGENIC EFFECTS : Not available.
    Toxicity to the reproductive system: Not available.
    There is no known effect from chronic exposure to this product. Repeated or prolonged exposure to this compound is not
    known to aggravate existing medical conditions.
    Acute Toxic Effects        No specific information is available in our data base regarding the toxic effects of this material for humans. However,    
    exposure to any chemical should be kept to a minimum. Skin and eye contact may result in irritation. May be harmful if
    inhaled or ingested. Always follow safe industrial hygiene practices and wear proper protective equipment when handling
    this compound.
    Continued on Next Page
    2-Isopropylnaphthalene (beta-)

Section XII.        Ecological Information    
    Ecotoxicity        Not available.    
    2-Isopropylnaphthalene is a component of crude oil and a product of combustion which is produced and released to the
    Environmental Fate
    environment during natural fires. Emissions from petroleum refining, coal tar distillation, and gasoline and diesel fueled
    engines are contributors of 2-isopropylnaphthalene to the environment. 2-Isopropylnaphthalene is also used as chemical
    intermediate and a general solvent. Consequently, 2-isopropylnaphthalene is released to the environment via
    manufacturing effluents. 2-Isopropylnaphthalene is also released to the environment by municipal waste incinerators.
    2-Isopropylnaphthalene should biodegrade in the environment. However, hydrolysis of 2-isopropylnaphthalene should not
    be important. In sunlit environmental media, 2-isopropylnaphthalene will undergo direct photolysis. 2-Isopropylnaphthalene
    is expected to be slightly mobile to immobile in soil. 2-Isopropylnaphthalene has the potential to bioconcentrate in aquatic
    organisms. 2-Isopropylnaphthalene may also partition from the water column to organic matter contained in sediments
    and suspended solids. Volatilization of 2-isopropylnaphthalene from environmental waters may be important. The
    volatilization half-lives from a model river and a model pond, the latter considers the effect of adsorption, have been
    estimated to be 5.2 hr and 93.6 days, respectively. 2-Isopropylnaphthalene is expected to exist entirely in the vapor phase
    in ambient air. In the atmosphere, reaction with photochemically produced hydroxyl radicals (half-life of 6.6 hr) is likely to
    be important. The most probable human exposure would be occupational exposure, which may occur through dermal
    contact or inhalation at places were 2-isopropylnaphthalene is produced or used. Non-occupational exposures would most
    likely occur via urban atmospheres, contaminated drinking water supplies and recreational activities at contaminated
    waterways. (Excerpted from HSDB, 1996)

Section XIII. Disposal Considerations
    Waste Disposal        Recycle to process, if possible. Consult your local or regional authorities. You may be able to dissolve or mix material with    
    a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber system. Observe all
    federal, state, and local regulations when disposing of this substance.

Section XIV. Transport Information
    DOT Classification        Not a DOT controlled material (United States).    
    PIN Number        NONE    
    Proper Shipping Name        NONE    
    Packing Group (PG)        NONE    
    DOT Pictograms

Section XV. Other Regulatory Information and Pictograms
    TSCA Chemical Inventory        This product is ON the EPA Toxic Substances Control Act (TSCA) inventory.    
    (EPA)
    WHMIS Classification        Not controlled under WHMIS (Canada).    
    (Canada)
    EINECS Number (EEC) Not available.
    EEC Risk Statements
    Not available.
    2-Isopropylnaphthalene (beta-)
    TCI laboratory chemicals are for research purposes only and are NOT intended for use as drugs, food additives, households, or pesticides. The information herein is believed to be correct, but does not
    claim to be all inclusive and should be used only as a guide. Neither the above named supplier nor any of its subsidiaries assumes any liability whatsoever for the accuracy or completeness of the
    information contained herein. Final determination of suitability of any material is the sole responsibility of the user. All chemical reagents must be handled with the recognition that their chemical,
    physiological, toxicological, and hazardous properties have not been fully investigated or determined. All chemical reagents should be handled only by individuals who are familiar with their potential
    hazards and who have been fully trained in proper safety, laboratory, and chemical handling procedures. Although certain hazards are described herein, we can not guarantee that these are the only hazards
    which exist. Our MSDS sheets are based only on data available at the time of shipping and are subject to change without notice as new information is obtained. Avoid long storage periods since the
    product is subject to degradation with age and may become more dangerous or hazardous. It is the responsibility of the user to request updated MSDS sheets for products that are stored for extended
    periods. Disposal of unused product must be undertaken by qualified personnel who are knowledgeable in all applicable regulations and follow all pertinent safety precautions including the use of
    appropriate protective equipment (e.g. protective goggles, protective clothing, breathing equipment, facial mask, fume hood). For proper handling and disposal, always comply with federal, state, and local
    regulations.


SECTION 16 - ADDITIONAL INFORMATION
N/A

2-异丙基萘 海关数据

中国海关编码:2902909090

概述:
2902909090. 其他芳香烃. 增值税率:17.0%. 退税率:9.0%. 监管条件:无. 最惠国关税:2.0%. 普通关税:30.0%
申报要素:
品名, 成分含量
摘要/Summary:
2902909090 other aromatic hydrocarbons。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:2.0%。General tariff:30.0%

2-异丙基萘 分子结构与计算化学数据

计算化学数据

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:0

3.氢键受体数量:0

4.可旋转化学键数量:1

5.互变异构体数量:无

6.拓扑分子极性表面积0

7.重原子数量:13

8.表面电荷:0

9.复杂度:159

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

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