67314-36-7 (六乙酰基-D-纤维二糖烯,Hexa-O-acetyl-cellobial,D-arabino-Hex-1-enitol,1,5-anhydro-2-deoxy-4-O-(2,3,4,6-tetra-O-acetyl-b-D-glucopyranosyl)-, 3,6-diacetate)

快速询单

结构式：

六乙酰基-D-纤维二糖烯,Hexa-O-acetyl-cellobialMOL文件

CAS号：

67314-36-7

中文名称：

六乙酰基-D-纤维二糖烯,Hexa-O-acetyl-cellobial

英文名称：

D-arabino-Hex-1-enitol,1,5-anhydro-2-deoxy-4-O-(2,3,4,6-tetra-O-acetyl-b-D-glucopyranosyl)-, 3,6-diacetate

分子式：

C₂₄H₃₂O₁₅

分子量：

560.501889228821

六乙酰基-D-纤维二糖烯,Hexa-O-acetyl-cellobial(67314-36-7)名称与标识符

名称

中文别名：

六乙酰基-D-纤维二糖烯;六乙酰基-D-纤维二糖烯,Hexa-O-acetyl-cellobial;

英文别名：

D-arabino-Hex-1-enitol,1,5-anhydro-2-deoxy-4-O-(2,3,4,6-tetra-O-acetyl-b-D-glucopyranosyl)-, 3,6-diacetate;2,3,6,2',3',4',6'-HEXA-O-ACETYL-D-CELLOBIAL;D-arabino-Hex-1-enitol,1,5-anhydro-2-deoxy-4-O-(2,3,4,6-tetra-O-acetyl-b-D-glucopyranosyl)-, 3...;Hexa-O-acetyl-cellobial;(2R,3R,4S,5R,6R)-2-((2R,3S,4R)-4-acetoxy-2-(acetoxymethyl)-3,4-dihydro-2H-pyran-3-yloxy)-6-(acetoxymethyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate;2',3,3',4',6,6'-hexa-O-acetyl-D-maltal;2,3,4,6-TETRAFLUOROBENZYLAMINE;3,6,2',3',4',6'-hexa-O-acetyl-D-maltal;Hexaacetyl-D-maltal;hexa-O-acetyl-D-maltal;Hexa-O-acetylmaltal;Maltal peracetate;per-O-acetyl-D-maltal;DTXSID701272992;67314-36-7;3,6,2',3',4',6'-HEXA-O-ACETYL-D-CELLOBIAL;

标识符

InChIKey：

RCDAESHZJBZWAW-VATBRQMMSA-N

Inchi：

1S/C24H32O15/c1-11(25)32-9-18-20(17(7-8-31-18)34-13(3)27)39-24-23(37-16(6)30)22(36-15(5)29)21(35-14(4)28)19(38-24)10-33-12(2)26/h7-8,17-24H,9-10H2,1-6H3/t17-,18-,19-,20+,21-,22+,23-,24+/m1/s1

SMILES：

O1[C@H](COC(C)=O)[C@H]([C@@H]([C@H]([C@@H]1O[C@H]1[C@@H](C=CO[C@@H]1COC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O

六乙酰基-D-纤维二糖烯,Hexa-O-acetyl-cellobial(67314-36-7)物化性质

实验特性

LogP : -0.13800
PSA : 185.49000
折射率 : 1.51
沸点 : 591.7 °C at 760 mmHg
闪点 : 249.2 °C
颜色与性状 : 无可用
溶解性 : 无可用
密度 : 1.34

计算特性

精确分子量 : 560.17400
氢键供体数量 : 0
氢键受体数量 : 15
可旋转化学键数量 : 16
同位素质量 : 560.17412
重原子数量 : 39
复杂度 : 959
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : =0.2
表面电荷 : 0
拓扑分子极性表面积 : 186

六乙酰基-D-纤维二糖烯,Hexa-O-acetyl-cellobial(67314-36-7)安全信息

安全说明： S24/25

六乙酰基-D-纤维二糖烯,Hexa-O-acetyl-cellobial(67314-36-7)推荐厂家更多厂家(1)

公司名称	手机号/电话	联系人	QQ	微信	询单
上海赛可锐生物科技有限公司	13003271654 021-58000709	赛可锐生物	3004122151		询单

六乙酰基-D-纤维二糖烯,Hexa-O-acetyl-cellobial(67314-36-7) MSDS

基础信息

Name:	Hexa-O-acetyl-cellobial Material Safety Data Sheet
Synonym:
CAS:	67314-36-7

Section 1 - Chemical Product ? MSDS Name:Hexa-O-acetyl-cellobial Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
67314-36-7	Hexa-O-acetyl-cellobial		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. 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# 67314-36-7: 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: Solid or liquid
Color: Not available.
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: C24H32O15
Molecular Weight: 560.51

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 67314-36-7 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Hexa-O-acetyl-cellobial - 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# 67314-36-7: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 67314-36-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 67314-36-7 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A