6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯,125995-13-3，生产厂家，价格-洛克化工网移动版

6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯

中文名称：: 6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯

中文别名：: 6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯;
(4R,6R)-6-氨乙基-2,2-二甲基n-1,3-二氧己环-4-乙酸叔丁酯;
6-氨乙基-2,2-二甲基-1,3-二氯六环-4-乙酸叔丁酯;
(4R,6R)-6-(氨乙基)-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯;
6-氨乙基-2,2-二甲基-1,3-二氧戊环-乙酸叔丁酯;
侧链ATS-9;
(4R,6R)-2,2-二甲基-6-(2-氨乙基)-1,3-二氧六环-4-乙酸叔丁酯;
2-[(4R,6R)-6-(2-氨乙基)-2,2-二甲基-1,3-二恶烷-4-基]乙酸叔丁酯;
ATROVASTATIN INTERMEDIATES;
6-氨乙基-2,2-二甲基-1,3-二氧戊环-4-乙酸叔丁酯

英文名称：: (4R,6R)-tert-Butyl-6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxane-4-acetate

英文别名：: (4R,6R)-tert-Butyl-6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxane-4-acetate;
[(4R,6R)-6-(2-Amino-ethyl)-2,2-dimethyl-[1,3]dioxan-4-yl]-acetic acid tert-butyl ester;
2-[(4R,6R)-6-(2-Aminoethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetic Acid tert-Butyl Ester;
(4R-cis)-1,1-dimethylethyl-[6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate;
tert-butyl [(4R,6R)-6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate;
(4R-cis)-6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxane-4-acetic acid tertiary butyl ester;
ATS-9;
tert-Butyl 6-aminoethyl-2,2-dimethyl-1,3-dioxolane-4-acetate;
(4R,Cis)-1,1-diMethylethyl6-aMinoethyl;
(4R-cis)-6-Hydroxymethyl-2,2-dimethyl-1,3-dioxane-4-acetic acid 1,1-dimethylethyl ester;
Atorvastatin Intermediate 1;
tert-butyl [(4R,6R)-6-aminoethyl-2,2-dimethyl-1,3-dioxan-4-yl]acetate;
(4R,6R)-Tert-Butyl-6-(2-Aminoe;
tert-butyl ((4R,6R)-6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxane-4-yl)acetate;
6R)-tert-Butyl-6-(2-aMinoethyl)-2;
2-diMethyl-1;
tert-Butyl 2-[(4R,6R)-6-(2-Aminoethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate;
4R,6R)-tert-Butyl-6-(2-aMinoethyl)-2,2-diMethyl-1;
3-dioxane-4-acetate;
tert-butyl 2-((4R,6R)-6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxan-4-yl)acetate

CAS No.：: 125995-13-3

分子式：: C₁₄H₂₇NO₄

分子量：: 273.37

精确分子量：: 273.19400

PSA：: 70.78000

MDL：: MFCD03701314

InChI：: InChI=1/C14H27NO4/c1-13(2,3)19-12(16)9-11-8-10(6-7-15)17-14(4,5)18-11/h10-11H,6-9,15H2,1-5H3/p+1/t10-,11-/m1/s13

安全术语：: S24/25

分子结构式：

SDS：: 查看

6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯制备方法及用途

制备方法

用作阿伐他汀钙侧链。

用途简介

6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯物化性质

外观与性状：: 淡黄色油性液体
密度：: 0.992 g/cm3
沸点：: 339.8ºC at 760 mmHg
闪点：: 96.8ºC
折射率：: 1.454-1.456
蒸汽压：: 8.94E-05mmHg at 25°C
存储条件/存储方法：: 密闭于阴凉干燥环境中
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：黄色粘性液体

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）：无可用

5.       沸点（ºC,常压）：无可用

6.       沸点（ºC,5.2kPa）：无可用

7.       折射率：1.454-1.456

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

6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯安全信息

海关代码：: 2932999099
安全说明：: S24/25
安全标志：: S24/25:防止皮肤和眼睛接触。

6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯毒理性

生态数据：

该物质对环境可能有危害，对水体应给予特别注意。

6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯 MSDS

Name:	(4R 6R)-t-Butyl-6-(2-aminoethyl)-2 2-dimethyl-1 3-dioxane-4-acetate Material Safety Data Sheet
Synonym:	None
CAS:	125995-13-3

Section 1 - Chemical Product MSDS Name:(4R 6R)-t-Butyl-6-(2-aminoethyl)-2 2-dimethyl-1 3-dioxane-4-acetate Material Safety Data Sheet
Synonym:None

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
125995-13-3	(4R,6R)-t-Butyl-6-(2-aminoethyl)-2,2-d	95	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.
Notes to Physician:
Treat symptomatically and supportively.

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:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable 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# 125995-13-3: 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: Viscous liquid
Color: clear yellow
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
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: C13H25NO4
Molecular Weight: 259.35

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, acids, acid chlorides, carbon dioxide, acid anhydrides.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 125995-13-3 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
(4R,6R)-t-Butyl-6-(2-aminoethyl)-2,2-dimethyl-1,3-dioxane-4-acetate - 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# 125995-13-3: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 125995-13-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 125995-13-3 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A

6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔丁酯海关数据

中国海关编码：2932999099

概述：: 2932999099. 其他仅含氧杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素：: 品名, 成分含量, 用途
摘要/Summary：: 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

6-氨乙基-2,2-二甲基-1,3-二氧六环-4-乙酸叔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：73.43

2、摩尔体积（m³/mol）：275.3

3、等张比容（90.2K）：668.6

4、表面张力（dyne/cm）：34.7

5、极化率（10^-24cm³）：29.11

计算化学数据

1、疏水参数计算参考值（XlogP）：1.1

2、氢键供体数量：1

3、氢键受体数量：4

4、可旋转化学键数量：6

5、拓扑分子极性表面积（TPSA）：72.4

6、重原子数量：19

7、表面电荷：1

8、复杂度：309

9、同位素原子数量：0

10、确定原子立构中心数量：2

11、不确定原子立构中心数量：0

12、确定化学键立构中心数量：0

13、不确定化学键立构中心数量：0

14、共价键单元数量：1