英语词典化工词典

b-D-Galactopyranoside,4-methoxyphenyl 2,6-bis-O-(phenylmethyl)-

b-D-Galactopyranoside,4-methoxyphenyl 2,6-bis-O-(phenylmethyl)-


  • 中文别名:4-甲氧苯基2,6-二-O-苄基-β-D-吡喃葡萄糖苷
  • 中文释义:4-甲氧苯基2,6-二-O-苄基-β-D-吡喃葡萄糖苷;4-甲氧苯基-2,6-二-O-苄基-Β-D-吡喃半乳糖苷;4-甲氧苯基2,6-二-O-苄基-Beta-D-吡喃半乳糖苷
  • 英文别名:(2R,3R,4S,5R,6S)-6-(4-methoxyphenoxy)-5-phenylmethoxy-2-(phenylmethoxymethyl)oxane-3,4-diol;
    M1634;
    4-Methoxyphenyl 2,6-Di-O-benzyl-β-D-galactopyranoside;
    4-Methoxyphenyl 2,6-di-O-benzyl-b-D-galactopyranoside 
  • CAS No.:159922-50-6
  • 分子式:C27H30O7
  • 分子量:466.52
  • 精确分子量:466.19900
  • PSA:86.61000
  • InChI:The Key: ZNONEMGWLHXQDN-LXSUACKSSA-N
  • 分子结构式:

物化性质

密度:
1.279g/cm3
熔点:
113ºC
沸点:
641.144ºC at 760 mmHg
闪点:
341.552ºC
蒸汽压:
0mmHg at 25°C
存储条件/存储方法:

保存方法: 冰箱内

其它信息:

1. 性状:未确定

2. 密度(g/mL,20℃):未确定

3. 相对蒸汽密度(g/mL,空气=1):未确定

4. 熔点(ºC):113

5. 沸点(ºC,常压):未确定

6. 沸点(ºC 0.1mmHg):未确定

7. 折射率:-1º

8. 闪点(ºF):未确定

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

密度:
1.279g/cm3
熔点:
113ºC
沸点:
641.144ºC at 760 mmHg
闪点:
341.552ºC
蒸汽压:
0mmHg at 25°C
存储条件/存储方法:

保存方法: 冰箱内

其它信息:

1. 性状:未确定

2. 密度(g/mL,20℃):未确定

3. 相对蒸汽密度(g/mL,空气=1):未确定

4. 熔点(ºC):113

5. 沸点(ºC,常压):未确定

6. 沸点(ºC 0.1mmHg):未确定

7. 折射率:-1º

8. 闪点(ºF):未确定

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

MSDS

4-Methoxyphenyl 2,6-Di-O-benzyl-β-D-Revision number: 5
galactopyranoside
SAFETY DATA SHEET
Section1. IDENTIFICATION
4-Methoxyphenyl 2,6-Di-O-benzyl-β-D-galactopyranoside
Product name:

Revision number:5
Section2. HAZARDS IDENTIFICATION
GHS classification
Not classified
PHYSICAL HAZARDS
HEALTH HAZARDSNot classified
Not classified
ENVIRONMENTAL HAZARDS
GHS label elements, including precautionary statements
None
Pictograms or hazard symbols
Signal wordNo signal word
None
Hazard statements
Precautionary statements:None
Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Substance/mixture:Substance
Components:4-Methoxyphenyl 2,6-Di-O-benzyl-β-D-galactopyranoside
Percent:>98.0%(LC)
CAS Number:159922-50-6
Chemical Formula:C27H30O7
Section4. 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. Rinse skin with
water/shower. 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.
Protection of first-aiders:A rescuer should wear personal protective equipment, such as rubber gloves and air-
tight goggles.
Section5. FIRE-FIGHTING MEASURES
Suitable extinguishingDry chemical, foam, water spray, carbon dioxide.
media:
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: Remove movable
containers if safe to do so.
4-Methoxyphenyl 2,6-Di-O-benzyl-β-D-
galactopyranoside
Section5. FIRE-FIGHTING MEASURES
When extinguishing fire, be sure to wear personal protective equipment.
Special protective
equipment for firefighters:
Section6. ACCIDENTAL RELEASE MEASURES
Personal precautions,Use personal protective equipment. Keep people away from and upwind of spill/leak.
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.
Section7. HANDLING AND STORAGE
Precautions for safe handling
Technical measures:Handling is performed in a well ventilated place. Wear suitable protective equipment.
Prevent dispersion of dust. Wash hands and face thoroughly after handling.
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 freezer.
Store away from incompatible materials such as oxidizing agents.
Heat-sensitive
Comply with laws.
Packaging material:
Section8. 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: 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.
Section9. PHYSICAL AND CHEMICAL PROPERTIES
Physical state (20°C):Solid
Form:Crystal- Powder
Colour:White - Very pale yellow
Odour:No data available
pH: No data available
Melting point/freezing point:113°C
Boiling point/range:No data available
Flash point:No data available
Flammability or explosive
limits:
Lower:No data available
Upper:No data available
No data available
Relative density:
Solubility(ies):
[Water]No data available
[Other solvents]
Slightly soluble:Chloroform
Section10. STABILITY AND REACTIVITY
Chemical stability:Stable under proper conditions.
4-Methoxyphenyl 2,6-Di-O-benzyl-β-D-
galactopyranoside
Section10. STABILITY AND REACTIVITY
Possibility of hazardous No special reactivity has been reported.
reactions:
Incompatible materials: Oxidizing agents
Hazardous decomposition Carbon monoxide, Carbon dioxide
products:
Section11. TOXICOLOGICAL INFORMATION
Acute Toxicity:No data available
Skin corrosion/irritation: No data available
Serious eyeNo data available
damage/irritation:
Germ cell mutagenicity: No data available
Carcinogenicity:
IARC =No data available
NTP =No data available
Reproductive toxicity:No data available
Section12. ECOLOGICAL INFORMATION
Ecotoxicity:
No data available
Fish:
Crustacea:No data available
No data available
Algae:
Persistence / degradability: No data available
No data available
Bioaccumulative
potential(BCF):
Mobility in soil
Log Pow:No data available
No data available
Soil adsorption (Koc):
Henry's LawNo data available
constant(PaM3/mol):
Section13. DISPOSAL CONSIDERATIONS
Recycle to process, if possible. Consult your local 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 the substance.
Section14. TRANSPORT INFORMATION
Hazards Class:Does not correspond to the classification standard of the United Nations
Not listed
UN-No:
Section15. 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.
4-Methoxyphenyl 2,6-Di-O-benzyl-β-D-
galactopyranoside
SECTION 16 - ADDITIONAL INFORMATION
N/A

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):3.2

2.氢键供体数量:2

3.氢键受体数量:7

4.可旋转化学键数量:10

5.互变异构体数量:无

6.拓扑分子极性表面积86.6

7.重原子数量:34

8.表面电荷:0

9.复杂度:555

10.同位素原子数量:0

11.确定原子立构中心数量:5

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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