C.I.酸性黑52

  • 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

C.I.酸性黑52 基本信息

中文名称:
C.I.酸性黑52 
中文别名:
C.I.酸性黑52;
中性络合黑 WA;
酸性黑 52;
永固黑WAN 
英文名称:
Palatine fast black WAN,pure
英文别名:
ACID BLACK 52;
PALATINE FAST BLACK WAN;
PALATINE FAST BLACK WAN,PURE;
C.I.AcidBlack52;
abcolblackwa;
PALATINE FAST BLACK WAN DYE CONTENT: 
CAS No.:
5610-64-0
分 子 式:
C60H36Cr2N9Na3O21S3
分 子 量:
1488.13
精确分子量:
1486.97000
PSA:
529.74000
MDL:
MFCD00013214
EINECS:
227-029-3
InChI:
InChI=1/C20H13N3O7S/c24-16-8-5-11-3-1-2-4-13(11)19(16)21-22-20-14-7-6-12(23(26)27)9-15(14)18(10-17(20)25)31(28,29)30/h1-10,24-25H,(H,28,29,30)
安全术语:
S24/25
分子结构式:
SDS:
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C.I.酸性黑52 制备方法及用途

制备方法

6-硝基-1,2,4- 酸重氮化, 与2- 萘酚偶合, 在水溶液中将产物与甲酸铬共同加热, 于115℃保持2h, 然后再混入一半相同批次的没有络合的染料, 并用氢氧化钠调成碱性, 进行干燥。其产品组成大约是2mol铬对2mol氮染料.

合成制备方法

6- 硝基-1,2,4- 酸重氮化, 与2- 萘酚偶合, 在水溶液中将产物与甲酸铬共同加热, 于115℃保持2h, 然后再混入一半相同批次的没有络合的染料, 并用氢氧化钠调成碱性, 进行干燥。其产品组成大约是2mol铬对2mol氮染料.

用途简介

C.I.酸性黑52 物化性质

外观与性状:
黑色粉末
密度:
1.64g/cm3
折射率:
1.747
存储条件/存储方法:

密封储存,储存于阴凉、干燥的库房。

稳定性相关:

1.常温常压下稳定,避免与强氧化剂接触。

2.遇浓硫酸呈暗蓝色, 稀释后生成黑色沉淀, 遇浓硝酸呈黄棕色溶液; 遇稀氢氧化钠溶液呈紫黑色

其它信息:

1.      性状:黑色粉末

2.      密度(g/mL,25℃):未确定

3.      相对蒸汽密度(g/mL,空气=1):未确定

4.      熔点(ºC):0

5.      沸点(ºC,常压):未确定

6.      沸点(ºC,11mmHg):未确定

7.      折射率(n20/D):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(mmHg,20ºC):未确定

12.   饱和蒸气压(kPa,25ºC):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:溶于水呈红光黑色, 可溶于乙醇和溶纤素, 微溶于丙酮, 不溶于其他有机溶剂.

C.I.酸性黑52 安全信息

安全说明:
S24/25
安全标志:
S24/25:防止皮肤和眼睛接触。

C.I.酸性黑52 MSDS

Name: Palatine Fast Black Wan Material Safety Data Sheet
Synonym: C.I. Acid Black 5
CAS: 5610-64-0
Section 1 - Chemical Product   MSDS Name:Palatine Fast Black Wan Material Safety Data Sheet
Synonym:C.I. Acid Black 5

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
5610-64-0 C.i. Acid Black 52 ca 100 227-029-3
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. The toxicological properties of this material have not been fully investigated.
Skin:
May cause skin irritation. The toxicological properties of this material have not been fully investigated.
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:
Chronic exposure to water insoluble hexavalent chromium compounds has been shown to be associated with lung cancer and gastrointestinal tract tumors.

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 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. Remove contaminated clothing and wash before reuse. 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# 5610-64-0: United Kingdom, WEL - TWA: (listed as chromium (vi) compounds): 0 mg/m3 TWA (as Cr) United Kingdom, WEL - STEL: (listed as chromium (vi) compounds): mg/m3 STEL (as Cr) France - VME: (listed as chromium (vi) compounds): 0.05 mg/m3 VME Cr) Germany: (listed as chromium (vi) compounds): 0.05 mg/m3 VME (as Japan: (listed as chromium (vi) compounds): 0.05 mg/m3 OEL (as Cr 0.01 mg/m3 OEL (certain compounds, as Cr) 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:
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: black
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: C60H36N9O21S3Na3.Cr2
Molecular Weight: 1488.01

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, dust generation, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, oxides of nitrogen, oxides of sulfur, irritating and toxic fumes and gases, carbon dioxide, sodium oxide, chromium dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 5610-64-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
C.i. Acid Black 52 - California: carcinogen, initial date 2/27/87 (listed as Chromium (VI) NTP: Known carcinogen (listed as Chromium (VI) compounds).
IARC: Group 1 carcinogen (listed as Chromium (VI) compounds).

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# 5610-64-0: 2
Canada
CAS# 5610-64-0 is listed on Canada's DSL List.
CAS# 5610-64-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 5610-64-0 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

C.I.酸性黑52 分子结构与计算化学数据

计算化学数据

1、   疏水参数计算参考值(XlogP):

2、   氢键供体数量:7

3、   氢键受体数量:27

4、   可旋转化学键数量:7

5、   互变异构体数量:588

6、   拓扑分子极性表面积(TPSA):483

7、   重原子数量:97

8、   表面电荷:0

9、   复杂度:1800

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:3

14、   不确定化学键立构中心数量:0

15、   共价键单元数量:7

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