16959-10-7 (2,4,6-三甲基-1,3-亚苯基二异氰酸盐,Benzene,2,4-diisocyanato-1,3,5-trimethyl-)

CAS号:
16959-10-7
中文名称:
2,4,6-三甲基-1,3-亚苯基二异氰酸盐
英文名称:
Benzene,2,4-diisocyanato-1,3,5-trimethyl-
分子式:
C11H10N2O2
分子量:
202.209302425385

2,4,6-三甲基-1,3-亚苯基二异氰酸盐(16959-10-7)名称与标识符

名称

中文别名:
2-(2-甲氧基苯基)-3-苯丙烯酸;2,4,6-三甲基-1,3-次苯基二异氰酸盐;N6-苄氧羰基-L-赖氨酸环内酸酐;三甲基-1,3-次苯基二异氰酸盐;2,3-二甲氧基-5-磺酰胺基苯甲酸;2,4,6-三甲基-1,3-亚苯基二异氰酸盐;
英文别名:
Benzene,2,4-diisocyanato-1,3,5-trimethyl-;2,4-diisocyanato-1,3,5-trimethylbenzene;1.3.5-Trimethylbenzen-2.4-diisocyanat;2,4,6-Trimethyl-1,3-phenylene diisocyanate;2,4,6-trimethylbenzene-1,3-diisocyanate;2,4,6-Trimethylbenzol-1,3-diyldiisocyanat;2,4,6-trimethylphenyl 1,3-diisocyanate;Mesitylendiisocyanat;2,4,6-Trimethyl-1,3-phenylene diisocyanate,98%;2,4,6-TRIMETHYL-1,3-PHENYLENE DIISO-CYANATE 98%;SCHEMBL441816;16959-10-7;DTXSID50369891;

标识符

InChIKey:
OSVNEGAPNXBADJ-UHFFFAOYSA-N
Inchi:
1S/C11H10N2O2/c1-7-4-8(2)11(13-6-15)9(3)10(7)12-5-14/h4H,1-3H3
SMILES:
O=C=NC1C(C)=CC(C)=C(C=1C)N=C=O

2,4,6-三甲基-1,3-亚苯基二异氰酸盐(16959-10-7)物化性质

实验特性

  • LogP : 2.54640
  • PSA : 58.86000
  • 折射率 : 1.5300 (estimate)
  • 沸点 : 102 °C0.4 mm Hg(lit.)
  • 熔点 : 57-60 °C(lit.)
  • 闪点 : >230 °F
  • 颜色与性状 : 无可用
  • 溶解性 : 无可用
  • 密度 : 1.2107 (rough estimate)

计算特性

  • 精确分子量 : 202.07400
  • 氢键供体数量 : 0
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 2
  • 同位素质量 : 202.074227566g/mol
  • 重原子数量 : 15
  • 复杂度 : 287
  • 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) : 4.6
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 58.9Ų

2,4,6-三甲基-1,3-亚苯基二异氰酸盐(16959-10-7)安全信息

2,4,6-三甲基-1,3-亚苯基二异氰酸盐(16959-10-7)海关数据

海关编码:
2929109000
海关数据:

中国海关编码:

2929109000

概述:

2929109000. 其他异氰酸酯. 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:30.0%

申报要素:

品名, 成分含量, 用途

Summary:

2929109000. other isocyanates. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

2,4,6-三甲基-1,3-亚苯基二异氰酸盐(16959-10-7)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
金锦乐(湖南)化学有限公司 金锦乐 1226360695
询单

2,4,6-三甲基-1,3-亚苯基二异氰酸盐(16959-10-7) MSDS

基础信息

Name:2 4 6-Trimethyl-1 3-phenylene diisocyanate Material Safety Data Sheet
Synonym:None
CAS:16959-10-7
Section 1 - Chemical Product ? MSDS Name:2 4 6-Trimethyl-1 3-phenylene diisocyanate Material Safety Data Sheet
Synonym:None

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
16959-10-72,4,6-Trimethyl-1,3-phenylene diisocya100unlisted
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.Moisture sensitive.
Potential Health Effects
Eye:
Causes eye irritation. Lachrymator (substance which increases the flow of tears).
Skin:
Causes skin irritation. Harmful if absorbed through the skin.
Organic isocyanates can cause local irritation and allergic reactions.
Ingestion:
Harmful if swallowed.
Inhalation:
Causes respiratory tract irritation. The toxicological properties of this substance have not been fully investigated. At high concentrations, isocyanates affect mucous membranes of the respiratory tract and may lead to fatal pulmonary edema. Exposure to low and often even unmeasurable isocyanate concentration results in sensitization.
Chronic:
Repeated or prolonged exposure may cause allergic reactions in sensitive individuals. Chronic overexposure to isocyanates has been reported to cause lung damage, including decreased lung fuction, which may be permanent.

Section 4 - FIRST AID MEASURES
? Eyes: Immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid. Do NOT allow victim to rub eyes or keep eyes closed.
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.
Ingestion:
Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or 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. 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:
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. 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.

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:
Wash thoroughly after handling. Use with adequate ventilation.
Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Do not allow contact with water. Wash clothing before reuse. Keep from contact with moist air and steam. Isocyanates react with water to form CO2 gas. This gas can cause sealed containers to expand and possibly rupture.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Store protected from moisture.

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# 16959-10-7: 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:
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.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Solid
Color: white to off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 102 deg C @ .40 mm Hg
Freezing/Melting Point: 57-60C
Autoignition Temperature: Not applicable.
Flash Point: > 109 deg C (> 228.20 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C11H10N2O2
Molecular Weight: 202.08

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Moisture, excess heat.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen cyanide, nitrogen oxides, carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Will not occur.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 16959-10-7 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2,4,6-Trimethyl-1,3-phenylene diisocyanate - 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: ISOCYANATES, TOXIC, N.O.S.*
Hazard Class: 6.1
UN Number: 2206
Packing Group: III
IMO
Shipping Name: ISOCYANATES, TOXIC, N.O.S.
Hazard Class: 6.1
UN Number: 2206
Packing Group: III
RID/ADR
Shipping Name: ISOCYANATES, TOXIC, N.O.S.
Hazard Class: 6.1
UN Number: 2206
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:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
WGK (Water Danger/Protection)
CAS# 16959-10-7: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 16959-10-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 16959-10-7 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A