邻苯基苯酚缩水甘油醚

邻苯基苯酚缩水甘油醚 基本信息
CAS号 7144-65-2 分子式 C15H14O2
分子量 226.27000 精确质量  226.09900
PSA  21.76000 LogP  3.13120

基本信息 展开↓

CAS号:
7144-65-2
3D弹球模型:
立即前往扯扯看
分子式:
C15H14O2
分子量:
226.27000
中文名称:
邻苯基苯酚缩水甘油醚
英文名称:
2-[(2-phenylphenoxy)methyl]oxirane
中文别名:
邻苯基苯酚缩水甘油醚;
3-(2-联苯)-1,2-环氧丙烷;
2-联苯缩水甘油醚
英文别名:
2-[(2-phenylphenoxy)methyl]oxirane;
1,2-epoxy-3-(2-phenylphenoxy)propane;
Biphenyl-2-yloxymethyl-oxiran;
biphenyl-2-yloxymethyl-oxirane;
3-(2-Xenyloxy)propylene oxide;
{[(1,1'-biphenyl)-2-yloxy]methyl}-oxirane;
Ether,2-biphenylyl 2,3-epoxypropyl;
OPP-G;
2-[(biphenyl-2-yloxy)methyl]oxirane;
3-(2-Biphenyloxy)propylene oxide;
2-biphenylyl glycidyl ether;
Biphenyl-2-yl 2,3-epoxypropyl ether
精确分子量/精确质量:
226.09900
极性分子表面积/PSA:
21.76000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
EINECS:
230-451-0
InChI:
InChI=1/C15H14O2/c1-2-6-12(7-3-1)14-8-4-5-9-15(14)17-11-13-10-16-13/h1-9,13H,10-11H2/t13-/m1/s1

物化性质展开↓

外观与性状:
白色至淡黄色低熔点固体
密度:
1.136g/cm3
熔点:
30-32ºC
沸点:
120ºC (0.1 torr)
闪点:
137.3ºC
折射率:
1.581
存储条件/存储方法:

密封于阴凉干燥处。

稳定性相关:

遵照规格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):30-32

5.       沸点(ºC,常压):120/0.1mmHg

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

安全信息展开↓

海关代码:
2910900090
WGK_Germany:
3
德国有关水污染物质的分类清单
危险类别码:
R36/37/38:Irritating to eyes, respiratory system and skin .
安全说明:
S26-S37/39
RTECS号:
SL7800000
危险标志:
Xi

合成路线查看所有的合成路线

  • 90-43-7

    联苯-2-酚

  • +

  • 106-89-8

    环氧氯丙烷

  • ~62%

  • 7144-65-2

    邻苯基苯酚缩水甘油醚

  • 20804-51-7

    20804-51-7

  • 7144-65-2

    邻苯基苯酚缩水甘油醚

  • 90-43-7

    联苯-2-酚

  • 7144-65-2

    邻苯基苯酚缩水甘油醚

化学图谱

  1. 3-(2-联苯)-1,2-环氧丙烷红外图谱(IR1)

  2. 3-(2-联苯)-1,2-环氧丙烷质谱(MS)

  3. 3-(2-联苯)-1,2-环氧丙烷核磁图(13CNMR)

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毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RR0356000
CHEMICAL NAME :
Oxirane, 2-((1,1'-biphenyl-2-yloxy)methyl)-
CAS REGISTRY NUMBER :
7144-65-2
LAST UPDATED :
199610
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H14-O2
MOLECULAR WEIGHT :
226.29

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
100 nmol/plate
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 206,115,1988
毒理学数据:

试验方法:
摄入剂量: 100 nmol /
测试对象:细菌-鼠伤寒沙门氏菌
毒性类型:突变
毒性作用:
详细的毒副作用没有报告以外的其他致死剂量值。

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。

MSDS 展开↓

Name: 2-Biphenylyl Glycidyl Ether 95% Material Safety Data Sheet
Synonym: 3-(2-Biphenylyloxy)-1,2-Epoxypropane; Ether, 2-Biphenyl 2,3-epoxypropyl
CAS: 7144-65-2
Section 1 - Chemical Product   MSDS Name:2-Biphenylyl Glycidyl Ether 95% Material Safety Data Sheet
Synonym:3-(2-Biphenylyloxy)-1,2-Epoxypropane; Ether, 2-Biphenyl 2,3-epoxypropyl

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
7144-65-2 2-Biphenylyl Glycidyl Ether 95% 230-451-0
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.
Inhalation:
Remove from exposure and move to fresh air immediately. If breathing is difficult, give oxygen. Get medical aid. If breathing has ceased apply artificial respiration using oxygen and a suitable mechanical device such as a bag and a mask.
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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
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. Remove contaminated clothing and wash before reuse. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Use with adequate ventilation.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

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 general or local exhaust ventilation to keep airborne concentrations below the permissible exposure limits.
Exposure Limits CAS# 7144-65-2: 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 and clothing 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
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 120 deg C @ .10mmHg
Freezing/Melting Point: 30.00 - 32.00 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:
Specific Gravity/Density:
Molecular Formula: C15H14O2
Molecular Weight: 226.27

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Incompatible materials, dust generation, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents, strong acids, strong bases.
Hazardous Decomposition Products:
Carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 7144-65-2: RR0356000 LD50/LC50:
Not available.
Carcinogenicity:
2-Biphenylyl Glycidyl Ether - 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.
WGK (Water Danger/Protection)
CAS# 7144-65-2: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 7144-65-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 7144-65-2 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

海关数据查看详细

中国海关编码:2910900090

概述:
2910900090. 三节环环氧化物,环氧醇(酚,醚),包括其卤化,磺化,硝化或亚硝化的衍生物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:5.5%. 普通关税:30.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2910900090. epoxides, epoxyalcohols, epoxyphenols and epoxyethers, with a three-membered ring, and their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

分子结构与计算化学数据展开↓

分子结构数据


1   摩尔折射率:66.36

2   摩尔体积m3/mol199.0

3   等张比容(90.2K):514.3

4   表面张力dyne/cm44.6

5   极化率10-24cm326.30

计算化学数据


1.疏水参数计算参考值(XlogP):3.2

2.氢键供体数量:0

3.氢键受体数量:2

4.可旋转化学键数量:4

5.互变异构体数量:无

6.拓扑分子极性表面积21.8

7.重原子数量:17

8.表面电荷:0

9.复杂度:235

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:1

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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