(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸

  • 基本信息
  • 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

(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸 基本信息

中文名称:
(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸 
中文别名:
(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸;
(4S)-n-(叔丁基二甲基甲硅烷基)氮杂啶-2-酮-4-羧酸 
英文名称:
2-Azetidinecarboxylicacid, 1-[(1,1-dimethylethyl)dimethylsilyl]-4-oxo-, (2S)-
英文别名:
(4S)-N-(tert-Butyldimethylsilyl)azetidin-2-one-4-carboxylic acid;
(2S)-1-[tert-butyl(dimethyl)silyl]-4-oxoazetidine-2-carboxylic acid 
CAS No.:
82938-50-9
分 子 式:
C10H19NO3Si
分 子 量:
229.35
精确分子量:
229.11300
PSA:
57.61000
MDL:
MFCD01862126
InChI:
The Key: LIEWITJXZYCDLE-ZETCQYMHSA-N
风险术语:
R36/37/38
安全术语:
S24/25
分子结构式:
SDS:
查看

(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸 物化性质

密度:
1.091g/cm3
熔点:
135-137ºC
沸点:
309.312ºC at 760 mmHg
闪点:
140.867ºC
折射率:
1.489
存储条件/存储方法:

 

密闭于0-6 ºC阴凉干燥环境中

稳定性相关:

 

遵照规定使用和储存则不会分解。

其它信息:

1.       性状:无可用

2.       密度(g/mL,25/4):无可用

3.       相对蒸汽密度(g/mL,空气=1):无可用

4.       熔点(ºC):135-137

5.       沸点(ºC,常压):无可用

6.       沸点(ºC,5.2kPa):无可用

7.       折射率:无可用

8.       闪点(ºC):无可用

9.       比旋光度(º):无可用

10.    自燃点或引燃温度(ºC):无可用

11.    蒸气压(kPa,25ºC):无可用

12.    饱和蒸气压(kPa,60ºC):无可用

13.    燃烧热(KJ/mol):无可用

14.    临界温度(ºC):无可用

15.    临界压力(KPa):无可用

16.    油水(辛醇/水)分配系数的对数值:无可用

17.    爆炸上限(%,V/V):无可用

18.    爆炸下限(%,V/V):无可用

19.    溶解性:无可用

(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸 安全信息

海关代码:
2933790090
危险类别码:
36/37/38
安全说明:
24/25
安全标志:
S24/25:防止皮肤和眼睛接触。

(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸 毒理性

生态数据:

 

通常对水是不危害的,若无政府许可,勿将材料排入周围环境。

(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸 MSDS

Name: (4S)-N-(tert-Butyldimethylsilyl)azetidin-2-one-4-carboxylic acid 99% Material Safety Data Sheet
Synonym:
CAS: 82938-50-9
Section 1 - Chemical Product   MSDS Name:(4S)-N-(tert-Butyldimethylsilyl)azetidin-2-one-4-carboxylic acid 99% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
82938-50-9 (4S)-N-(tert-Butyldimethylsilyl)azetid 99 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. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
May cause respiratory tract irritation. May be harmful if inhaled.
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 water spray, dry chemical, carbon dioxide, or chemical foam.

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# 82938-50-9: 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: Solid
Color: white - off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 135 - 137 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:
Specific Gravity/Density:
Molecular Formula: C10H19NO3Si
Molecular Weight: 229.35

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:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 82938-50-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
(4S)-N-(tert-Butyldimethylsilyl)azetidin-2-one-4-carboxylic acid - 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
No information available.
IMO
No information available.
RID/ADR
No information available.

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# 82938-50-9: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 82938-50-9 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 82938-50-9 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸 海关数据

中国海关编码:2933790090

概述:
2933790090 其他内酰胺. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:9.0% 普通关税:20.0%
申报要素:
品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
摘要/Summary:
2933790090. other lactams. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:9.0%. General tariff:20.0%

(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸 分子结构与计算化学数据

分子结构数据

1、   摩尔折射率:60.68

2、   摩尔体积(m3/mol):210.2

3、   等张比容(90.2K):508.9

4、   表面张力(dyne/cm):34.3

5、   极化率10-24cm3):24.05

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:1

3.氢键受体数量:3

4.可旋转化学键数量:3

5.互变异构体数量:2

6.拓扑分子极性表面积57.6

7.重原子数量:15

8.表面电荷:0

9.复杂度:306

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

(4S)-N-(叔丁基二甲基硅)氮杂环丁烷-2-酮-4-羧酸 上游产品

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