4-(p-氯苯甲酰)哌嗪盐酸盐

  • 基本信息
  • 物化性质
  • 安全信息
  • 毒理性
  • MSDS
  • 结构与计算化学
  • 上游产品
  • 下游产品

4-(p-氯苯甲酰)哌嗪盐酸盐 基本信息

中文名称:
4-(p-氯苯甲酰)哌嗪盐酸盐 
中文别名:
4-(p-氯苯甲酰)哌嗪盐酸盐;
4-(4-氯苯甲酰基)哌啶盐酸盐;
(4-氯苯基)(4-哌啶)甲酮盐酸盐 
英文名称:
Methanone,(4-chlorophenyl)-4-piperidinyl-, hydrochloride (1:1)
英文别名:
(4-Chlorophenyl)(4-piperidinyl)methanone hydrochloride;
(4-chlorophenyl)-piperidin-4-ylmethanone,hydrochloride 
CAS No.:
55695-51-7
分 子 式:
C12H14ClNO.ClH
分 子 量:
260.16
精确分子量:
259.05300
PSA:
29.10000
InChI:
InChI=1/C12H14ClNO.ClH/c13-11-3-1-9(2-4-11)12(15)10-5-7-14-8-6-10;/h1-4,10,14H,5-8H2;1H
风险术语:
R36/37/38
安全术语:
S26S36/S37/S39
分子结构式:
SDS:
查看

4-(p-氯苯甲酰)哌嗪盐酸盐 物化性质

熔点:
238-239°C
沸点:
356.2ºC at 760 mmHg
闪点:
169.2ºC
存储条件/存储方法:

保持贮藏器密封、储存在阴凉、干燥的地方,确保工作间有良好的通风或排气装置

稳定性相关:

如果遵照规格使用和储存则不会分解,未有已知危险反应

        

其它信息:

1.       性状:未确定

2.       密度(g/mL,20ºC):未确定

3.       相对蒸汽密度(g/mL,空气=1): 未确定

4.       熔点(ºC):238-239

5.       沸点(ºC):未确定

6.       沸点(ºC20mm hg):未确定

7.       折射率:未确定

8.       闪点(°C):未确定

9.       比旋光度(ºC):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

4-(p-氯苯甲酰)哌嗪盐酸盐 安全信息

危险类别码:
R36/37/38
安全说明:
S26-S36/37/39
安全标志:
S26:万一接触眼睛,立即使用大量清水冲洗并送医诊治。
:
危险标志:
Xi

4-(p-氯苯甲酰)哌嗪盐酸盐 毒理性

生态数据:

对水是稍微有危害的不要让未稀释或大量的产品接触地下水、水道或者污水系统,若无政府许可,勿将材料排入周围环境。

4-(p-氯苯甲酰)哌嗪盐酸盐 MSDS

Name: (4-Chlorophenyl)(4-piperidyl)methanone hydrochloride 95+% Material Safety Data Sheet
Synonym: 4-(4-Chlorobenzoyl)piperidine hydrochlorid
CAS: 55695-51-7
Section 1 - Chemical Product   MSDS Name:(4-Chlorophenyl)(4-piperidyl)methanone hydrochloride 95+% Material Safety Data Sheet
Synonym:4-(4-Chlorobenzoyl)piperidine hydrochlorid

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
55695-51-7 (4-Chlorophenyl)(4-piperidyl)methanone 95+% 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:
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# 55695-51-7: 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
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 238 - 239 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:
Specific Gravity/Density:
Molecular Formula: C12H15Cl2NO
Molecular Weight: 260

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents, acids, bases, acid chlorides.
Hazardous Decomposition Products:
Hydrogen chloride, chlorine, nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 55695-51-7 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
(4-Chlorophenyl)(4-piperidyl)methanone hydrochloride - 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
No information available.
IMO
No information available.
RID/ADR
No information available.

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# 55695-51-7: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 55695-51-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 55695-51-7 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

4-(p-氯苯甲酰)哌嗪盐酸盐 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):2.3

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:2

5、   互变异构体数量:2

6、   拓扑分子极性表面积(TPSA):33.7

7、   重原子数量:15

8、   表面电荷:1

9、   复杂度:218

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

4-(p-氯苯甲酰)哌嗪盐酸盐 上游产品

4-(p-氯苯甲酰)哌嗪盐酸盐 下游产品

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爱斯特(成都)生物制药有限公司

产品介绍:
产品名称:55695-51-7 Cas号:55695-51-7 纯度:98% 包装信息:25kg 价格:洽谈
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武汉琼格生物科技有限公司

产品介绍:
产品名称:4-(4-氯苯甲酰基)哌啶盐酸盐 Cas号:55695-51-7 纯度:0.97 包装信息:5g,5g,5g,5g,5g 价格:604.0元 - 604.0元
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