N-苄基马来酰亚胺

N-苄基马来酰亚胺 基本信息
CAS号 1631-26-1 分子式 C11H9NO2
分子量 187.19500 精确质量  187.06300
PSA  37.38000 LogP  1.04950

基本信息 展开↓

CAS号:
1631-26-1
3D弹球模型:
立即前往扯扯看
分子式:
C11H9NO2
分子量:
187.19500
中文名称:
N-苄基马来酰亚胺
英文名称:
N-Benzylmaleimide
中文别名:
N-苄基马来酰亚胺;
苄基马来酰亚胺
英文别名:
N-Benzylmaleimide;
1-benzylpyrrole-2,5-dione;
1-Benzylpyrrole-2,5-dione
精确分子量/精确质量:
187.06300
极性分子表面积/PSA:
37.38000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
贝尔斯坦号/MDL:
MFCD00014540
EINECS:
216-631-1
PubChem:
24865502
BRN:
135801
InChI:
InChI=1/C11H9NO2/c13-10-6-7-11(14)12(10)8-9-4-2-1-3-5-9/h1-7H,8H2

生产制备方法及用途展开↓

制备方法


塑料添加剂。

用途简介


物化性质展开↓

外观与性状:
片状
密度:
1 g/cm3
熔点:
70 °C(lit.)
沸点:
177 °C / 20mmHg
闪点:
157.9ºC
水溶解性:
Insoluble
折射率:
1.625
蒸汽压:
9.61E-05mmHg at 25°C
存储条件/存储方法:

保持容器密封,储存在阴凉,干燥的地方 

稳定性相关:

常温常压下稳定,避免氧化物 接触

其它信息:

1.       性状:固体。

2.       密度(g/mL,25/4): 1

3.       相对蒸汽密度(g/mL,空气=1):未确定

4.       熔点(ºC):70-72

5.       沸点(ºC,常压):177

6.       沸点(ºC,5.2kPa): 未确定

7.       折射率: 未确定

8.       闪点(ºC): 157

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(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: 1.78

17.    爆炸上限(%,V/V):未确定

18.    爆炸下限(%,V/V): 未确定

19.    溶解性:能溶于水。

安全信息展开↓

包装等级:
III
风险类别:
8
海关代码:
2925190090
WGK_Germany:
3
德国有关水污染物质的分类清单
危险类别码:
R20/21;R25;R34
安全说明:
S26-S36/37/39-S45
危险标志:
T:Toxic;

合成路线查看所有的合成路线

  • 272449-67-9

    272449-67-9

  • ~98%

  • 1631-26-1

    N-苄基马来酰亚胺

  • 903758-94-1

    903758-94-1

  • ~95%

  • 1631-26-1

    N-苄基马来酰亚胺

  • 108-31-6

    马来酸酐

  • +

  • 100-46-9

    苯甲胺

  • ~93%

  • 1631-26-1

    N-苄基马来酰亚胺

化学图谱

  1. N-苄基马来酰亚胺红外图谱(IR1)

  2. N-苄基马来酰亚胺红外图谱(IR2)

  3. N-苄基马来酰亚胺质谱(MS)

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毒理性展开↓

毒理学数据:

对眼睛、皮肤、粘膜有刺激作用。

生态数据:

对水是稍微有害的,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

MSDS 展开↓

Name: N-Benzylmaleimide Material Safety Data Sheet
Synonym: None Known
CAS: 1631-26-1
Section 1 - Chemical Product   MSDS Name:N-Benzylmaleimide Material Safety Data Sheet
Synonym:None Known

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
1631-26-1 N-Benzylmaleimide ca. 100 216-631-1
Hazard Symbols: C
Risk Phrases: 34

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Causes burns.Corrosive.
Potential Health Effects
Eye:
Causes eye burns. May cause chemical conjunctivitis and corneal damage.
Skin:
Causes skin burns. May cause skin rash (in milder cases), and cold and clammy skin with cyanosis or pale color.
Ingestion:
May cause severe and permanent damage to the digestive tract. Causes gastrointestinal tract burns. May cause perforation of the digestive tract. The toxicological properties of this substance have not been fully investigated. May cause systemic effects.
Inhalation:
Causes chemical burns to the respiratory tract. The toxicological properties of this substance have not been fully investigated.
Aspiration may lead to pulmonary edema. May cause systemic effects.
Chronic:
Effects may be delayed.

Section 4 - FIRST AID MEASURES
  Eyes: Get medical aid immediately. Do NOT allow victim to rub eyes or keep eyes closed. Extensive irrigation with water is required (at least 30 minutes).
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse. Destroy contaminated shoes.
Ingestion:
Do not induce vomiting. 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 immediately.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If breathing is difficult, give oxygen. Do NOT use mouth-to-mouth resuscitation. If breathing has ceased apply artificial respiration using oxygen and a suitable mechanical device such as a bag and a mask.
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 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. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions.
Provide ventilation.

Section 7 - HANDLING and STORAGE
  Handling:
Minimize dust generation and accumulation. Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing.
Keep container tightly closed. Do not ingest or inhale. Use only in a chemical fume hood. Discard contaminated shoes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Corrosives area.

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# 1631-26-1: 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: Solid
Color: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 70 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: C11H9NO2
Molecular Weight: 187.20

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Incompatible materials, dust generation.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 1631-26-1 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
N-Benzylmaleimide - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
  Ecotoxicity:
Fish: Pseudomonas putida:

Section 13 - DISPOSAL CONSIDERATIONS
  Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
 
IATA
Shipping Name: NOT REVIEWED.
Hazard Class:
UN Number:
Packing Group:
IMO
Shipping Name: NOT REVIEWED.
Hazard Class:
UN Number:
Packing Group:
RID/ADR
Shipping Name: NOT REVIEWED.
Hazard Class:
UN Number:
Packing group:

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 34 Causes burns.
Safety Phrases:
S 25 Avoid contact with eyes.
S 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
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# 1631-26-1: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 1631-26-1 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 1631-26-1 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

海关数据查看详细

中国海关编码:2925190090

概述:
2925190090 其他酰亚胺及其衍生物盐. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2925190090 other imides and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

分子结构与计算化学数据展开↓

分子结构数据


1、   摩尔折射率:51.04

2、   摩尔体积(m3/mol):144.3

3、   等张比容(90.2K):398.7

4、   表面张力(dyne/cm):58.1

5、   介电常数(F/m):不可用

6、   极化率10-24cm3):20.23

计算化学数据


1.疏水参数计算参考值(XlogP):1

2.氢键供体数量:0

3.氢键受体数量:2

4.可旋转化学键数量:2

5.互变异构体数量:无

6.拓扑分子极性表面积37.4

7.重原子数量:14

8.表面电荷:0

9.复杂度:259

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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