N-(p-Toluenesulfonyl)-DL-methionine

  • 基本信息
  • 物化性质
  • 安全信息
  • MSDS
  • 结构与计算化学
  • 上游产品
  • 下游产品

N-(p-Toluenesulfonyl)-DL-methionine 基本信息

中文名称:
N-(p-Toluenesulfonyl)-DL-methionine 
中文别名:
N-(p-Toluenesulfonyl)-DL-methionine;
Aurora 584 2-[[(4-Methylphenyl)sulfonyl]amino]-4-(methylthio)butanoic acid Akos bbs-00006602 Salor-int l101184-1ea N-(P-Toluenesulfonyl)-d,l-methionine N-Tosyl-dl-methionine Timtec-bb sbb009906 
英文名称:
Methionine,N-[(4-methylphenyl)sulfonyl]-
英文别名:
2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanoate;
AURORA 584;
N-Tosyl-DL-methionin;
N-TOSYL-DL-METHIONINE 
CAS No.:
4703-33-7
分 子 式:
C12H17NO4S2
分 子 量:
303.4
精确分子量:
303.06000
PSA:
117.15000
MDL:
MFCD00425359
InChI:
The Key: WURIPAYKVUIDHJ-UHFFFAOYSA-N
风险术语:
36/37/38
安全术语:
S24/25
分子结构式:
SDS:
查看

N-(p-Toluenesulfonyl)-DL-methionine 物化性质

外观与性状:
灰白色至略米色结晶粉末
熔点:
105-108ºC
沸点:
510.7ºC at 760mmHg
闪点:
262.7ºC
存储条件/存储方法:

密封储存,储存于阴凉、干燥的库房。

稳定性相关:

常温常压下稳定,避免与不相容材料接触。

其它信息:

1.      性状:灰白色或浅米色结晶性粉末

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):105-108

5.      沸点(ºC,常压):未确定

6.      沸点(ºC,11mmHg):未确定

7.      折射率(n20/D):未确定

8.      闪点(ºC):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(mPa,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:不溶于水

N-(p-Toluenesulfonyl)-DL-methionine 安全信息

危险类别码:
R36/37/38
安全说明:
24/25-37/39-26
安全标志:
S24/25:防止皮肤和眼睛接触。
危险标志:
Xi

N-(p-Toluenesulfonyl)-DL-methionine MSDS

Name: N-(p-Toluenesulfonyl)-DL-methionine 98% Material Safety Data Sheet
Synonym:
CAS: 4703-33-7
Section 1 - Chemical Product   MSDS Name:N-(p-Toluenesulfonyl)-DL-methionine 98% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
4703-33-7 N-(p-Toluenesulfonyl)-DL-methionine 98% unlisted
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Not available.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation.
Chronic:
Not available.

Section 4 - FIRST AID MEASURES
  Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
  General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use extinguishing media most appropriate for the surrounding fire.

Section 6 - ACCIDENTAL RELEASE MEASURES
  General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.

Section 7 - HANDLING and STORAGE
  Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
  Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 4703-33-7: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
 
Physical State: Crystalline powder
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 104 - 106 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water: insoluble
Specific Gravity/Density:
Molecular Formula:
Molecular Weight: 303.39

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, carbon dioxide.
Hazardous Polymerization: Will not occur.

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 4703-33-7 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
N-(p-Toluenesulfonyl)-DL-methionine - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
 

Section 13 - DISPOSAL CONSIDERATIONS
  Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
 
IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 4703-33-7: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 4703-33-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 4703-33-7 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

N-(p-Toluenesulfonyl)-DL-methionine 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):2.5

2、   氢键供体数量:1

3、   氢键受体数量:5

4、   可旋转化学键数量:6

5、   互变异构体数量:

6、   拓扑分子极性表面积(TPSA):86.3

7、   重原子数量:19

8、   表面电荷:-1

9、   复杂度:378

10、   同位素原子数量:0

11、   确定原子立构中心数量:1

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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