1746-25-4 (2,4,5-三碘咪唑,2,4,5-Triiodo-1H-imidazole)

CAS号:
1746-25-4
中文名称:
2,4,5-三碘咪唑
英文名称:
2,4,5-Triiodo-1H-imidazole
安全信息:
分子式:
C3HI3N2
分子量:
445.766856908798

2,4,5-三碘咪唑(1746-25-4)名称与标识符

名称

中文别名:
2,4,5-三碘咪唑;2,4,5-三碘-1H-咪唑;2,4,5-三碘咪唑?;5-(2R)-2-环氧乙烷基-8-苄氧基-2(1H)-喹啉酮;2,4,5-三碘-1<i>H<;i>-咪唑;
英文别名:
2,4,5-Triiodo-1H-imidazole;2,4,5-triiodo-imidazol;2,4,5-TRIIODOIMIDAZOLE;1H-Imidazole, 2,4,5-triiodo-;Imidazole, 2,4,5-triiodo-;HIDCNJIBRZBEPN-UHFFFAOYSA-N;C3HI3N2;PubChem9642;2,5-Triiodoimidazole;Imidazole,4,5-triiodo-;1H-Imidazole,4,5-triiodo-;Jsp003577;1H-Imidazole,2,4,5-triiodo-;2,4,5-Triiodo-1H-imidazole #;BCP21606;2,4,5-tris(iodanyl)-1H-imidazole;WT1317;NSC222411;FT-0609812;NSC 222411;BRN 0115451;MFCD00068812;DTXSID70169855;SY031068;EN300-1654596;A811675;F13339;CS-W004209;NSC-222411;SCHEMBL306801;PS-10951;AKOS003617905;2,4,5-Triiodo-1H-imidazole;1H-Imidazole, 2,4,5-triiodo-;Imidazole, 2,4,5-triiodo-;B39A7ADJ9J;1746-25-4;AM20090041;BAA74625;J-507061;T3369;AB92855;RGW-809;1H-Imidazole, 2,4,5-triiodo-(9CI);DTXCID8092346;DB-019815;

标识符

MDL:
MFCD00068812
InChIKey:
HIDCNJIBRZBEPN-UHFFFAOYSA-N
Inchi:
1S/C3HI3N2/c4-1-2(5)8-3(6)7-1/h(H,7,8)
SMILES:
IC1=C(N=C(N1)I)I
BRN:
0115451

2,4,5-三碘咪唑(1746-25-4)物化性质

实验特性

  • LogP : 2.22350
  • PSA : 28.68000
  • 折射率 : 1.864
  • 沸点 : 459.2 ºC at 760 mmHg
  • 熔点 : 184.0 to 190.0 deg-C
  • 闪点 : 231.5 ºC
  • 颜色与性状 : 晶体
  • 密度 : 3.504

计算特性

  • 精确分子量 : 445.72700
  • 氢键供体数量 : 1
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 0
  • 同位素质量 : 445.727
  • 重原子数量 : 8
  • 复杂度 : 88.6
  • 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) : 2.8
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 28.7

2,4,5-三碘咪唑(1746-25-4)国际标准相关数据

EINECS:
222411

2,4,5-三碘咪唑(1746-25-4)海关数据

海关编码:
2933290090
海关数据:

中国海关编码:

2933290090

概述:

2933290090. 其他结构含非稠合咪唑环的化合物. 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

Summary:

2933290090. other compounds containing an unfused imidazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2,4,5-三碘咪唑(1746-25-4)上下游

2,4,5-三碘咪唑(1746-25-4)相关文献

2,4,5-三碘咪唑(1746-25-4)参考资料

Reaxys RN:
115451
PubChem CID:

2,4,5-三碘咪唑(1746-25-4) MSDS

基础信息

Name:2 4 5-Triiodo-1h-imidazole 97% Material Safety Data Sheet
Synonym:
CAS:1746-25-4
Section 1 - Chemical Product ? MSDS Name:2 4 5-Triiodo-1h-imidazole 97% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
1746-25-42,4,5-Triiodo-1H-imidazole97%unlisted
Hazard Symbols: XN
Risk Phrases: 20/21/22 22 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed.
Harmful if swallowed. Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
Harmful if swallowed. May cause irritation of the digestive tract.
Inhalation:
Causes respiratory tract irritation. May be harmful if inhaled.
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.

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# 1746-25-4: 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: Solid
Color: beige
Odor: odorless - slight odor
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: C3HI3N2
Molecular Weight: 445.76

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide, hydrogen iodide, iodine.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 1746-25-4: NI8680000 LD50/LC50:
CAS# 1746-25-4: Oral, rat: LD50 = 278 mg/kg.
Carcinogenicity:
2,4,5-Triiodo-1H-imidazole - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

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 SOLID, ORGANIC, N.O.S.*
Hazard Class: 6.1
UN Number: 2811
Packing Group: III
IMO
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2811
Packing Group: III
RID/ADR
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2811
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 22 Harmful 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.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 1746-25-4: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 1746-25-4 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 1746-25-4 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A