3-甲氧基-3-甲基醋酸丁酯

  • 基本信息
  • 物化性质
  • 安全信息
  • MSDS
  • 海关数据
  • 结构与计算化学

3-甲氧基-3-甲基醋酸丁酯 基本信息

中文名称:
3-甲氧基-3-甲基醋酸丁酯 
中文别名:
3-甲氧基-3-甲基醋酸丁酯;
乙酸-3-甲氧基-3-甲基丁酯;
3-甲氧基-3-甲基-1-醋酸丁酯 
英文名称:
1-Butanol,3-methoxy-3-methyl-, 1-acetate
英文别名:
(3-methoxy-3-methylbutyl) acetate;
3-Methoxy-3-Methylbutyl Acetate;
Acetic Acid 3-Methoxy-3-methylbutyl Ester;
3-Methyl-3-methoxybutyl acetate;
3-Methoxy-3-methylbutyl Acetate 
CAS No.:
103429-90-9
分 子 式:
C8H16O3
分 子 量:
160.21
精确分子量:
160.10995
PSA:
35.53000
风险术语:
R36/37/38
安全术语:
S26S36/S37/S39
分子结构式:
SDS:
查看

3-甲氧基-3-甲基醋酸丁酯 物化性质

密度:
0.939g/cm3
沸点:
191ºC at 760mmHg
闪点:
62.1ºC
折射率:
1.413
蒸汽压:
0.525mmHg at 25°C
其它信息:

 

3-甲氧基-3-甲基醋酸丁酯 安全信息

海关代码:
2915390090
危险类别码:
36/37/38
安全说明:
26-36/37/39
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。
:

3-甲氧基-3-甲基醋酸丁酯 MSDS

  3-Methoxy-3-methylbutyl Acetate      Revision number: 1    
  SAFETY DATA SHEET

Section 1. BASE INFORMATION
  Product name:        3-Methoxy-3-methylbutyl Acetate    

  Revision number:        1    

Section 2. HAZARDS IDENTIFICATION
  Classification of the GHS
  PHYSICAL HAZARDS
  Flammable liquids        Category 4    
  HEALTH HAZARDS
  Acute toxicity (Oral)        Category 5    
    Category 4
  Acute toxicity (Dermal)
  ENVIRONMENTAL HAZARDS        Not classified    
  GHS label elements
  Pictograms or hazard symbols
  Signal word        Warning    
  Hazard statement        Combustible liquid    
    May be harmful if swallowed
    Harmful in contact with skin
  Precautionary statements
  [Prevention]        Keep away from flames and hot surfaces.    
    Wear protective gloves and eye/face protection.
  [Response]        IF ON SKIN: Gently wash with plenty of soap and water.    
    Wash contaminated clothing before reuse.
    Call a POISON CENTER or doctor/physician if you feel unwell.
    Store in a well-ventilated place. Keep cool.
  [Storage]
  [Disposal]        Dispose of contents/container through a waste management company authorized by    
    the local government

Section 3. COMPOSITION/INFORMATION ON INGREDIENTS
  Substance/mixture:        Substance    
  Component(s):        3-Methoxy-3-methylbutyl Acetate    
  Percent:        >98.0%(GC)    
  CAS Number:        103429-90-9    
    Acetic Acid 3-Methoxy-3-methylbutyl Ester
  Synonyms:
  Chemical Formula:        C8H16O3    
  3-Methoxy-3-methylbutyl Acetate

Section 4. FIRST AID MEASURES
  Inhalation:        Remove victim to fresh air and keep at rest in a position comfortable for breathing.    
    Call a POISON CENTER or doctor/physician 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:        Call a POISON CENTER or doctor/physician 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, carbon dioxide.    
  media:
  Extinguishing media not to Water (It may scatter and spread fire.)
  be used:
  Specific methods:        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: Remove movable
    containers 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
  Personal precautions,        Use personal protective equipment. Keep people away from and upwind of spill/leak.    
  protective equipment and Ensure adequate ventilation. Entry to non-involved personnel should be controlled
  emergency procedures: around the leakage area by roping off, etc.
  Environmental precautions: Prevent product from entering drains.
  Methods and materials for Absorb spilled material in a suitable absorbent (e.g. rag, dry sand, earth, saw-dust).
  containment and cleaning In case of large amount of spillage, contain a spill by bunding. Adhered or collected
  up: material should be promptly disposed of, in accordance with 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
  Handling
  Technical measures:        Handling is performed in a well ventilated place. Wear suitable protective equipment.    
    Prevent generation of vapor or mist. Keep away from flames and hot surfaces. Take
    measures to prevent the build up of electrostatic charge. Use explosion-proof
    equipment. Wash hands and face thoroughly after handling.
    Use a closed system, ventilation.
  Advice on safe handling:        Avoid contact with skin, eyes and clothing.    
  Storage
  Storage conditions:        Keep container tightly closed. Store in a cool, dark and well-ventilated place.    
    Store away from incompatible materials such as oxidizing agents.
  Packaging material:        Law is followed.    

Section 8. EXPOSURE CONTROLS / PERSONAL PROTECTION
  Engineering controls:        Install a closed system or local exhaust as possible so that workers should not be    
    exposed directly. Also install safety shower and eye bath.
  Personal protective equipment
  Respiratory protection: Vapor respirator. Follow local and national regulations.
  Hand protection:        Protective gloves.    
    Safety glasses. A face-shield, if the situation requires.
  Eye protection:
  Skin and body protection: Protective clothing. Protective boots, if the situation requires.
  3-Methoxy-3-methylbutyl Acetate

Section 9. PHYSICAL AND CHEMICAL PROPERTIES
  Physical state (20°C):        Liquid    
    clear
  Form:
  Color:        Colorless - Almost colorless    
    No data available
  Odor:
  pH: No data available
  Melting point/freezing point:No data available
  Boiling Point/Range:        74 °C/2kPa    
    73°C
  Flash Point:
  Explosive limits
  Lower:        No data available    
  Upper:        No data available    
    0.96
  Density:
  Solubility:        No data available    

Section 10. STABILITY AND REACTIVITY
  Stability:        Stable under proper conditions.    
  Reactivity:        No special reactivity has been reported.    
  Incompartible materials: oxidizing agents
  Hazardous Decomposition Carbon monoxide, Carbon dioxide
  Products:

Section 11. TOXICOLOGICAL INFORMATION
    No data available
  Acute Toxicity:
  Skin corrosion/irritation: No data available
    No data available
  Serious eye
  damage/irritation:
  Germ cell mutagenicity: No data available
  Carcinogenicity:
  IARC =        No data available    
  NTP =        No data available    
    No data available
  Reproductive toxicity:

Section 12. ECOLOGICAL INFORMATION
  Ecotoxicity:
    No data available
  Fish:
  Crustacea:        No data available    
  Algae:        No data available    
  Persistence / degradability: 88 - 91% (by BOD), 96 - 97% (by TOC), 100% (by GC)
  Bioaccumulative        No data available    
  potential(BCF):
  Mobillity in soil
  log Pow:        No data available    
    No data available
  Soil adsorption (Koc):
  Henry's Law        No data available    
  constant(PaM3/mol):

Section 13. DISPOSAL CONSIDERATIONS
    Recycle to process, if possible. Consult your local regional authorities. You may be able to burn in a chemical
    incinerator equipped with an afterburner and scrubber system. Observe all federal, state and local regulations when
    disposing of the substance.

Section 14. TRANSPORT INFORMATION
  Hazards Class:        Does not correspond to the classification standard of the United Nations    
    Not Listed
  UN-No:
  3-Methoxy-3-methylbutyl Acetate

Section 15. REGULATORY INFORMATION
  Safe management ordinance of dangerous chemical product (State Council announces on January 26,
  2002): Safe use and production, the storage of a dangerous chemical, transport, loading and unloading were
    prescribed.


SECTION 16 - ADDITIONAL INFORMATION
N/A

3-甲氧基-3-甲基醋酸丁酯 海关数据

中国海关编码:2915390090

概述:
2915390090. 其他乙酸酯. 增值税率:17.0%. 退税率:13.0%. 监管条件:AB(入境货物通关单,出境货物通关单). 最惠国关税:5.5%. 普通关税:30.0%
申报要素:
品名, 成分含量, 用途
监管条件:
A.入境货物通关单B.出境货物通关单
检验检疫:
R.进口食品卫生监督检验S.出口食品卫生监督检验M.进口商品检验N.出口商品检验
摘要/Summary:
2915390090. esters of acetic acid. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:5.5%. General tariff:30.0%

3-甲氧基-3-甲基醋酸丁酯 分子结构与计算化学数据

分子结构数据

1、摩尔折射率:42.59

2、摩尔体积(cm3/mol):170.4

3、等张比容(90.2K):389.9

4、表面张力(dyne/cm):27.3

5、介电常数:无可用的

6、极化率(10-24cm3):16.88

7、单一同位素质量:160.109944 Da

8、标称质量:160 Da

9、平均质量:160.2108 Da

计算化学数据

1.疏水参数计算参考值(XlogP):0.9

2.氢键供体数量:0

3.氢键受体数量:3

4.可旋转化学键数量:5

5.互变异构体数量:无

6.拓扑分子极性表面积35.5

7.重原子数量:11

8.表面电荷:0

9.复杂度:129

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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