4-Piperidinamine,1-(phenylmethyl)-, hydrochloride (1:2)
- 中文别名:4-氨基-1-苄基哌啶二盐酸盐水合物
- 中文释义:4-氨基-1-二氢氯化苯甲基哌啶;4-氨基-1-苄基哌啶二盐酸盐水合物;1-苄基-4-氨基哌啶二盐酸盐
- 英文别名:1-Benzylpiperidin-4-amine dihydrochloride;
4-PIPERIDINAMINE,1-(PHENYLMETHYL)-, HYDROCHLORIDE (1:2);
4-AMINO-1-BENZYLPIPERIDIN DIHYDROCHLORID HYDRATE;
1-BENZYL-4-AMINOPIPERIDINE;
1-benzylpiperidin-4-amine dihydrochloride;
1-BENZYL-4-AMINOPIPERIDINE 2HCL;
1-BENZYL-4-AMINOPIPERIDINE DIHYDROCHLORIDE;
4-AMINO-1-BENZYLPIPERIDINE 2HCLHYDRATE;
4-AMINO-1-BENZYLPIPERIDINE DIHYDROCHLORIDEHYDRATE;
4-Amino-1-benzylpiperidine dihydrochloride hydrate;
4-AMINO-1-BENZYLPIPERIDINE DIHYDROCHLORIDE;
1-BENZYL-4-AMINOPIPERIDINEDIHYDROCHLORIDE;
CH04545 1-BENZYL-4-AMINOPIPERIDINE DIHYDROCHLORIDE
- CAS No.:1205-72-7
- 分子式:C12H18N2.2ClH
- 分子量:226.74600
- 精确分子量:226.12400
- PSA:29.26000
- InChI:InChI=1/C12H18N2/c13-12-6-8-14(9-7-12)10-11-4-2-1-3-5-11/h1-5,12H,6-10,13H2/p+2
- 分子结构式:
物化性质
- 外观与性状:
- 淡黄色至白色
- 沸点:
- 349ºC at 760 mmHg
- 闪点:
- 164.8ºC
- 蒸汽压:
- 0.00363mmHg at 25°C
- 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:
常温常压下稳定,避免与强氧化剂接触。
4-氨基-1-苄基哌啶二盐酸盐水合物 安全信息
- 海关代码:
- 2933399090
- 安全说明:
- S24/25
- 安全标志:
- S24/25:防止皮肤和眼睛接触。
安全信息
- 外观与性状:
- 淡黄色至白色
- 沸点:
- 349ºC at 760 mmHg
- 闪点:
- 164.8ºC
- 蒸汽压:
- 0.00363mmHg at 25°C
- 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:
常温常压下稳定,避免与强氧化剂接触。
4-氨基-1-苄基哌啶二盐酸盐水合物 安全信息
- 海关代码:
- 2933399090
- 安全说明:
- S24/25
- 安全标志:
- S24/25:防止皮肤和眼睛接触。
MSDS
Name: | 4-Amino-1-benzylpiperidine dihydrochloride hydrate Material Safety Data Sheet |
Synonym: | |
CAS: | 1205-72-7 |
Section 1 - Chemical Product MSDS Name:4-Amino-1-benzylpiperidine dihydrochloride hydrate Material Safety Data Sheet
Synonym:
Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# | Chemical Name | content | EINECS# |
1205-72-7 | 4-Amino-1-benzylpiperidine dihydrochlo | | 214-886-3 |
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:
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.
Get medical aid immediately.
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. Remove contaminated clothing and shoes.
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. Get medical aid immediately. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or water.
Inhalation:
Get medical aid immediately. 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:
Clean up spills immediately, observing precautions in the Protective Equipment section. Sweep up or absorb material, then place into a suitable clean, dry, closed container for disposal. Provide ventilation.
Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
Storage:
Store in a cool, dry place. Keep container closed when not in use.
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. Use process enclosure, local exhaust ventilation, or other engineering controls to control airborne levels.
Exposure Limits CAS# 1205-72-7: Personal Protective Equipment Eyes: Wear chemical splash goggles. 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 minimize contact with skin. Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use. 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: Crystalline powder
Color: very slight yellow to white
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: C12H18N2.2HCl.xH2O
Molecular Weight: 263.20
Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures. Stability unknown.
Conditions to Avoid:
Incompatible materials, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Irritating and toxic fumes and gases.
Hazardous Polymerization: Not available.
Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 1205-72-7 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
4-Amino-1-benzylpiperidine dihydrochloride hydrate - 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.
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# 1205-72-7: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 1205-72-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 1205-72-7 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
中国海关编码:2933399090
- 概述:
- 2933399090. 其他结构含非稠合吡啶环的化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
- 申报要素:
- 品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
- 摘要/Summary:
- 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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:1
3、 氢键受体数量:3
4、 可旋转化学键数量:2
5、 互变异构体数量:
6、 拓扑分子极性表面积(TPSA):29.3
7、 重原子数量:15
8、 表面电荷:-1
9、 复杂度:156
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:2