172223-58-4 (4-(3-吡啶)-苯硼酸,Cyclohexene, 1-(2-isocyanoethyl)-)

CAS号:
172223-58-4
中文名称:
4-(3-吡啶)-苯硼酸
英文名称:
Cyclohexene, 1-(2-isocyanoethyl)-
分子式:
C9H13N
分子量:
135.206222295761

4-(3-吡啶)-苯硼酸(172223-58-4)名称与标识符

名称

中文别名:
1-(2-异氰乙基)环己烷;2-环己烷-1-异氰乙基;2-环己烯-1-乙基异丁酯;4-(3-吡啶)-苯硼酸;
英文别名:
Cyclohexene, 1-(2-isocyanoethyl)-;1-(2-isocyanoethyl)cyclohexene;2-Cyclohexen-1-ylethyl isocyanide;1-(2-isocyanoethyl)cyclohexane;Cyclohexene,1-(2-isocyanoethyl);2-CYCLOHEXEN-1-YLETHYLISOCYANIDE;2-Cyclohexen-1-ylethyl isocyanide,96%;A811387;172223-58-4;J-010808;EN300-6512474;1-(2-isocyanoethyl)cyclohex-1-ene;AKOS006342685;DTXSID70370500;

标识符

MDL:
MFCD02664625
InChIKey:
KKAZBUBQJPTCKA-UHFFFAOYSA-N
Inchi:
1S/C9H13N/c1-10-8-7-9-5-3-2-4-6-9/h5H,2-4,6-8H2
SMILES:
[N+](#[C-])CCC1=CCCCC1

4-(3-吡啶)-苯硼酸(172223-58-4)物化性质

实验特性

  • LogP : 2.02690
  • PSA : 0.00000
  • 折射率 : 1.4765-1.4785
  • 沸点 : 52-58 °C (1.5 mmHg)
  • 颜色与性状 : 黄色液体
  • 溶解性 : 不溶于水
  • 密度 : 0.9

计算特性

  • 精确分子量 : 135.10500
  • 氢键供体数量 : 0
  • 氢键受体数量 : 0
  • 可旋转化学键数量 : 2
  • 同位素质量 : 135.105
  • 重原子数量 : 10
  • 复杂度 : 170
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 2
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 4.4A^2

4-(3-吡啶)-苯硼酸(172223-58-4)安全信息

4-(3-吡啶)-苯硼酸(172223-58-4)推荐厂家 更多厂家(1)

公司名称手机号/电话联系人QQ微信询单
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021-68882955
张经理 2423903095
询单

4-(3-吡啶)-苯硼酸(172223-58-4) MSDS

基础信息

Name:2-Cyclohexen-1-ylethyl isocyanide 96% Material Safety Data Sheet
Synonym:1-(2-Isocyanoethyl)cyclohexan
CAS:172223-58-4
Section 1 - Chemical Product ? MSDS Name:2-Cyclohexen-1-ylethyl isocyanide 96% Material Safety Data Sheet
Synonym:1-(2-Isocyanoethyl)cyclohexan

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
172223-58-42-Cyclohexen-1-ylethyl isocyanide96%unlisted
Hazard Symbols: XN
Risk Phrases: 20/21/22 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed.
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. Harmful if absorbed through the skin.
Ingestion:
Harmful if swallowed. May cause irritation of the digestive tract.
Inhalation:
Harmful if inhaled. 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. Will burn if involved in a fire.
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:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable 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:
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# 172223-58-4: 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: Liquid
Color: light yellow - yellow-brown
Odor: stench
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 52 - 58 deg C @1.5Pa
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: Insoluble.
Specific Gravity/Density: 0.900
Molecular Formula: C9H13N
Molecular Weight: 135.21

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, oxides of nitrogen, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 172223-58-4 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-Cyclohexen-1-ylethyl isocyanide - 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: TOXIC LIQUID, ORGANIC, N.O.S.*
Hazard Class: 6.1
UN Number: 2810
Packing Group: III
IMO
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2810
Packing Group: III
RID/ADR
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2810
Packing group: III

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XN
Risk Phrases:
R 20/21/22 Harmful by inhalation, in contact with
skin and if swallowed.
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
WGK (Water Danger/Protection)
CAS# 172223-58-4: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 172223-58-4 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 172223-58-4 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A