1-(对-甲苯基)哌嗪二盐酸盐

  • 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

1-(对-甲苯基)哌嗪二盐酸盐 基本信息

中文名称:
1-(对-甲苯基)哌嗪二盐酸盐 
中文别名:
1-(4-甲苯基)哌嗪二盐酸盐;
1-(对-甲苯基)哌嗪二盐酸盐;
1-(对甲苯)哌嗪双盐酸盐 
英文名称:
Piperazine,1-(4-methylphenyl)-, hydrochloride (1:2)
英文别名:
1-(p-Tolyl)piperazine dihydrochloride;
1-(P-TOLYL)PIPERAZINE DIHYDROCHLORIDE 
CAS No.:
13078-14-3
分 子 式:
C11H16N2.2ClH
分 子 量:
249.18
精确分子量:
248.08500
PSA:
15.27000
MDL:
MFCD00035286
EINECS:
235-975-3
BRN:
5639546
InChI:
The Key: HAIMQMXHKJAQBW-UHFFFAOYSA-N
危险品标志:
IrritantXi
风险术语:
R36/37/38
安全术语:
S26;S37/39
分子结构式:
SDS:
查看

1-(对-甲苯基)哌嗪二盐酸盐 物化性质

熔点:
214ºC
沸点:
321.2ºC at 760mmHg
闪点:
153.8ºC
蒸汽压:
0.000303mmHg at 25°C
存储条件/存储方法:

常温密闭,阴凉通风干燥

稳定性相关:

常温常压下稳定

避免的物料 氧化物 水分/潮湿
其它信息:

1.       性状:暗红色固体

1-(对-甲苯基)哌嗪二盐酸盐 安全信息

危险类别码:
R36/37/38
安全说明:
S26-S37/39
危险标志:
Xi:Irritant;

1-(对-甲苯基)哌嗪二盐酸盐 毒理性

毒理学数据:

主要的刺激性影响:

在皮肤上面:刺激皮肤和粘膜

在眼睛上面:刺激的影响

致敏作用:没有已知的敏化现象

生态数据:

通常对水体是稍微有害的,不要将未稀释或大量产品接触地下水,水道或污水系统,未经政府许可勿将材料排入周围环境。

1-(对-甲苯基)哌嗪二盐酸盐 MSDS

Name: 1-(4-Methylphenyl)piperazine dihydrochloride Material Safety Data Sheet
Synonym: N-(p-Tolyl)piperazine dihydrochlorid
CAS: 13078-14-3
Section 1 - Chemical Product   MSDS Name:1-(4-Methylphenyl)piperazine dihydrochloride Material Safety Data Sheet
Synonym:N-(p-Tolyl)piperazine dihydrochlorid

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
13078-14-3 1-(4-Methylphenyl)piperazine dihydroch 235-975-3
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.Hygroscopic (absorbs moisture from the air).
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes respiratory tract irritation.
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. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
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. Avoid generating dusty conditions.

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:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 13078-14-3: 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: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 214 - 216 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: C11H16N2.2HCl
Molecular Weight: 249.18

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, exposure to moist air or water.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, oxides of nitrogen, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 13078-14-3 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1-(4-Methylphenyl)piperazine dihydrochloride - 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
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing Group:
IMO
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing Group:
RID/ADR
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing group:

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 13078-14-3: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 13078-14-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 13078-14-3 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

1-(对-甲苯基)哌嗪二盐酸盐 分子结构与计算化学数据

分子结构数据

1、   摩尔折射率:54.63

2、   摩尔体积(m3/mol):174.0

3、   等张比容(90.2K):427.2

4、   表面张力(dyne/cm):36.3

5、   极化率10-24cm3):21.65

计算化学数据

1、   氢键供体数量:3

2、   氢键受体数量:2

3、   可旋转化学键数量:1

4、   拓扑分子极性表面积(TPSA):15.3

5、   重原子数量:15

6、   表面电荷:0

7、   复杂度:144

8、   同位素原子数量:0

9、   确定原子立构中心数量: 0

10、   不确定原子立构中心数量:0

11、   确定化学键立构中心数量:0

12、   不确定化学键立构中心数量:0

13、   共价键单元数量:3

1-(对-甲苯基)哌嗪二盐酸盐 上游产品

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