三苯甲醇

  • 基本信息
  • 制备方法及用途
  • 物化性质
  • 安全信息
  • MSDS
  • 结构与计算化学
  • 上游产品
  • 下游产品
  • 表征图谱

三苯甲醇 基本信息

中文名称:
三苯甲醇 
中文别名:
三苯基甲醇;
羟基三苯基甲烷;
三苯甲醇 
英文名称:
Triphenylmethanol
英文别名:
Triphenylmethanol;
triphenylmethyl alcohol;
triphenylcarbinole;
diphenyl-phenyl carbinol;
PH3C-OH;
Ih-Tetrazole;
TRT-OH;
BL 3756;
triphenyl methanol;
Tritylcarbinol;
TRITYL ALCOHOL;
Tritanol;
TRIPHENYLCARBINOL 
CAS No.:
76-84-6
分 子 式:
C19H16O
分 子 量:
260.33
精确分子量:
260.12000
PSA:
20.23000
MDL:
MFCD00004445
EINECS:
200-988-5
BRN:
1460837
InChI:
InChI=1/C19H16O/c20-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,20H
危险品标志:
风险术语:
R38   
安全术语:
S24/25;
分子结构式:
SDS:
查看

三苯甲醇 制备方法及用途

制备方法

由三苯氯甲烷水解,或溴化苯基镁(格利雅试剂)与二苯甲酮(或苯甲酸乙酯)制备。

合成制备方法

由三苯氯甲烷水解,或溴化苯基镁(格利雅试剂)与二苯甲酮(或苯甲酸乙酯)制备。

用途简介

用作合成试剂及中间体。

用途

用作合成试剂及中间体。

三苯甲醇 物化性质

外观与性状:
白色至灰白色粉末
密度:
1.13 g/cm3
熔点:
160-163 °C(lit.)
沸点:
360 °C(lit.)
闪点:
360-380°C
水溶解性:
INSOLUBLE
折射率:
1.621
存储条件/存储方法:

阴凉处密封保存。

其它信息:

        1.       性状:片状晶体。

2.       密度(g/mL,25/4℃):1.199

3.       相对蒸汽密度(g/mL,空气=1):不确定

4.       熔点(ºC):164.2

5.       沸点(ºC,常压):380

6.       沸点(ºC,5.2kPa):不确定

7.       折射率:1.489625℃)

8.       闪点(ºC):不确定

9.       比旋光度(º):-14.7°(c=2.5,氯仿)

10.    自燃点或引燃温度(ºC):不确定

11.    蒸气压(kPa,25ºC):不确定

12.    饱和蒸气压(kPa,60ºC):不确定

13.    燃烧热(KJ/mol):不确定

14.    临界温度(ºC):不确定

15.    临界压力(KPa):不确定

16.    油水(辛醇/水)分配系数的对数值:不确定

17.    爆炸上限(%,V/V):不确定

18.    爆炸下限(%,V/V):不确定

19.    溶解性:不溶于水和石油醚,溶于乙醇、乙醚、丙酮、苯,溶于浓硫酸显黄色,溶于冰乙酸时无色

 

 

 

 

 

三苯甲醇 安全信息

海关代码:
29062900
WGK_Germany:
3
德国有关水污染物质的分类清单
危险类别码:
R38
安全说明:
S22-S24/25
安全标志:
S22:不要吸入粉尘。
S24/25:防止皮肤和眼睛接触。
危险标志:
Xi:Irritant;

三苯甲醇 MSDS

Name: Triphenylmethanol 97% Material Safety Data Sheet
Synonym: Triphenylcarbinol; Trityl alcoho
CAS: 76-84-6
Section 1 - Chemical Product   MSDS Name:Triphenylmethanol 97% Material Safety Data Sheet
Synonym:Triphenylcarbinol; Trityl alcoho

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
76-84-6 Triphenylmethanol 97.0 200-988-5
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:
None

Section 4 - FIRST AID MEASURES
  Eyes: Immediately 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 if irritation develops or persists. Flush skin with plenty of soap and water.
Ingestion:
If victim is conscious and alert, give 2-4 cupfuls of milk or water.
Never give anything by mouth to an unconscious person. Get medical aid.
Inhalation:
Remove from exposure and move to fresh air immediately. Get medical aid if cough or other symptoms appear.
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:
In case of fire, use water, dry chemical, chemical foam, or alcohol-resistant foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
  General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Sweep up or absorb material, then place into a suitable clean, dry, closed container for disposal. Avoid generating dusty conditions.

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.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
  Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 76-84-6: 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 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: Powder
Color: beige
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 380 deg C @ 760.00mmHg
Freezing/Melting Point: 164.2 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: insoluble
Specific Gravity/Density: 1.199
Molecular Formula: C19H16O
Molecular Weight: 260.32

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, strong oxidants.
Incompatibilities with Other Materials:
Acids - acid chlorides - acid anhydrides - oxidizing agents.
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# 76-84-6 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Triphenylmethanol - 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# 76-84-6: 2
Canada
CAS# 76-84-6 is listed on Canada's DSL List.
CAS# 76-84-6 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 76-84-6 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

三苯甲醇 分子结构与计算化学数据

分子结构数据

      1、   摩尔折射率:81.07

2、   摩尔体积(m3/mol):230.2

3、   等张比容(90.2K):601.1

4、   表面张力(dyne/cm):46.4

5、   极化率10-24cm3):32.13

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:1

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20.2

7.重原子数量:20

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: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

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