3-O-乙酰基-1,2:5,6-二-O-异丙基-α-D-呋喃(型)葡萄糖,16713-80-7，生产厂家，价格-洛克化工网移动版

3-O-乙酰基-1,2:5,6-二-O-异丙基-α-D-呋喃(型)葡萄糖

中文名称：: 3-O-乙酰基-1,2:5,6-二-O-异丙基-α-D-呋喃(型)葡萄糖

中文别名：: 3-O-乙酰基-1,2:5,6-二-O-异丙基-Alpha-D-呋喃(型)葡萄糖;
3-O-乙酰基-1,2:5,6-二-O-异丙基-Α-D-呋喃(型)葡萄糖

英文名称：: a-D-Glucofuranose,1,2:5,6-bis-O-(1-methylethylidene)-, 3-acetate

英文别名：: [(3aR,5R,6S,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl] acetate;
1,2:5,6-di-O-isopropylidene-3-acetyl-D-glucofuranose;
Diaceton-D-glucosylacetat;
3-O-acetyl-1,2,5,6-diisopropylidene-D-glucose

CAS No.：: 16713-80-7

分子式：: C₁₄H₂₂O₇

分子量：: 302.32

精确分子量：: 302.13700

PSA：: 72.45000

EINECS：: 209-567-0

InChI：: The Key: QZKDRLZSJSWQPS-RMPHRYRLSA-N3

风险术语：: R36/37/38

安全术语：: S24/25

分子结构式：

SDS：: 查看

3-O-乙酰基-1,2:5,6-二-O-异丙基-α-D-呋喃(型)葡萄糖物化性质

外观与性状：: 白色结晶固体
密度：: 1.4g/cm3
熔点：: 60-62 °C(lit.)
沸点：: 333.3ºC at 760mmHg
闪点：: 147.5ºC
折射率：: 1.512
其它信息：: 1. 性状：未确定

2. 密度（g/mL,25/4℃）：未确定

3. 相对蒸汽密度（g/mL,空气=1）：未确定

4. 熔点（ºC）：60-62 °C(lit.)
5. 沸点（ºC,常压）：未确定

6. 沸点（ºC,5.2kPa）：未确定

7. 折射率：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（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

3-O-乙酰基-1,2:5,6-二-O-异丙基-α-D-呋喃(型)葡萄糖安全信息

WGK_Germany：: 2
德国有关水污染物质的分类清单
危险类别码：: R36/37/38
安全说明：: S24/25
RTECS号：: LZ4910000
安全标志：: S24/25:防止皮肤和眼睛接触。
危险标志：: Xi

3-O-乙酰基-1,2:5,6-二-O-异丙基-α-D-呋喃(型)葡萄糖毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :: LZ4910000

CAS REGISTRY NUMBER :: 16713-80-7

BEILSTEIN REFERENCE NO. :: 0033303

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C14-H22-O7

MOLECULAR WEIGHT :: 302.36

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >4 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 29,986,1979

毒理学数据：: 急性毒性：大鼠口经LD50:>4 gm/kg

3-O-乙酰基-1,2:5,6-二-O-异丙基-α-D-呋喃(型)葡萄糖 MSDS

Name:	3-O-Acetyl-1 2:5 6-Di-O-Isopropylidene-Alpha-D-Glucofuranose 98% Material Safety Data Sheet
Synonym:	1,2:5,6-Bis-O-(1-Methylethylidene)-Alpha-D-glucofuranose Acetate
CAS:	16713-80-7

Section 1 - Chemical Product MSDS Name:3-O-Acetyl-1 2:5 6-Di-O-Isopropylidene-Alpha-D-Glucofuranose 98% Material Safety Data Sheet
Synonym:1,2:5,6-Bis-O-(1-Methylethylidene)-Alpha-D-glucofuranose Acetate

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
16713-80-7	3-O-Acetyl-1,2:5,6-Di-O-Isopropylidene	98%	unlisted

Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
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. The toxicological properties of this substance have not been fully investigated.
Chronic:
No information found.

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. Wash clothing before reuse.
Ingestion:
Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or water. 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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use agent most appropriate to extinguish fire. Use water spray, dry chemical, carbon dioxide, or appropriate 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. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions.
Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Use with adequate ventilation.
Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep refrigerated. (Store below 4C/39F.)

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 16713-80-7: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Powder
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 60 - 62 deg C
Autoignition Temperature: Not applicable.
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water: slightly soluble
Specific Gravity/Density:
Molecular Formula: C14H22O7
Molecular Weight: 302.1498

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, dust generation, excess heat.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Will not occur.

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 16713-80-7: LZ4910000 LD50/LC50:
CAS# 16713-80-7: Oral, mouse: LD50 = >4 gm/kg.
Carcinogenicity:
3-O-Acetyl-1,2:5,6-Di-O-Isopropylidene-Alpha-D- Glucofuranose - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

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.
S 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 16713-80-7: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 16713-80-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 16713-80-7 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A

3-O-乙酰基-1,2:5,6-二-O-异丙基-α-D-呋喃(型)葡萄糖分子结构与计算化学数据

分子结构数据

1、摩尔折射率：71.20

2、摩尔体积（m³/mol）：241.2

3、等张比容（90.2K）：611.8

4、表面张力（dyne/cm）：41.3

5、极化率（10^-24cm³）：28.22

计算化学数据

1.疏水参数计算参考值（XlogP）:0.6

2.氢键供体数量:0

3.氢键受体数量:7

4.可旋转化学键数量:3

5.互变异构体数量:无

6.拓扑分子极性表面积72.4

7.重原子数量:21

8.表面电荷:0

9.复杂度:433

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

3-O-乙酰基-1,2:5,6-二-O-异丙基-α-D-呋喃(型)葡萄糖下游产品

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