1124-08-9 (2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉,1,4-Diiodo-2,5-dimethylbenzene)

CAS号:
1124-08-9
中文名称:
2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉
英文名称:
1,4-Diiodo-2,5-dimethylbenzene
安全信息:
分子式:
C8H8I2
分子量:
357.958066940308

2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉(1124-08-9)名称与标识符

名称

中文别名:
1,4-二碘-2,5-二甲基苯;1,4-二碘-2,5-二甲苯;2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉;
英文别名:
Benzene,1,4-diiodo-2,5-dimethyl-;1,4-Diiodo-2,5-dimethylbenzene;2,5-diiodo-1,4-dimethylbenzene;2,5-Diiodo-1,4-xylene;2,5-diiodo-para-xylene;2,5-Diiodo-p-xylene;2,5-dimethyl-1,4-diiodobenzene;CDS1_000279;2,5-diiodo-rho-xylene;Maybridge1_002567;DivK1c_001319;C8H8I2;HMS548M15;WJYYUEQVECTILJ-UHFFFAOYSA-N;OR0399;BTB 13663;FCH1319515;VZ20710;RP07053;1,4-bis(iodanyl)-2,5-dimethyl-benzene;Y7072;A802572;MFCD00829126;AMY15519;Z276509550;YSSJ2339;W-204783;FT-0606880;SCHEMBL1685558;D5589;5-Nitrofurfuraldiacetate;s10429;EN300-207806;CS-0061168;AKOS015909131;SY234729;AS-19765;1124-08-9;DTXSID30371179;BAA12408;DB-041088;

标识符

MDL:
MFCD00829126
InChIKey:
WJYYUEQVECTILJ-UHFFFAOYSA-N
Inchi:
1S/C8H8I2/c1-5-3-8(10)6(2)4-7(5)9/h3-4H,1-2H3
SMILES:
IC1C=C(C)C(=CC=1C)I

2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉(1124-08-9)物化性质

实验特性

  • LogP : 3.51260
  • PSA : 0.00000
  • 折射率 : 1.665
  • 沸点 : 306.2°C at 760 mmHg
  • 熔点 : 102.0 to 106.0 deg-C
  • 闪点 : 147.6°C
  • 密度 : 2.154

计算特性

  • 精确分子量 : 357.87200
  • 氢键供体数量 : 0
  • 氢键受体数量 : 0
  • 可旋转化学键数量 : 0
  • 同位素质量 : 357.872
  • 重原子数量 : 10
  • 复杂度 : 99.8
  • 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
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 0

2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉(1124-08-9)安全信息

2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉(1124-08-9)海关数据

海关编码:
2903999090
海关数据:

中国海关编码:

2903999090

概述:

2903999090 其他芳烃卤化衍生物. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%

申报要素:

品名, 成分含量, 用途

Summary:

2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

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2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉(1124-08-9)上下游

2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉(1124-08-9)参考资料

Reaxys RN:
1860783
PubChem CID:

2-(六氢-1H-氮杂卓-4-基)-1,2,3,4-四氢异喹啉(1124-08-9) MSDS

基础信息

Name:1 4-Diiodo-2 5-dimethylbenzene 97% Material Safety Data Sheet
Synonym:2,5-Diiodo-1,4-xylen
CAS:1124-08-9
Section 1 - Chemical Product ? MSDS Name:1 4-Diiodo-2 5-dimethylbenzene 97% Material Safety Data Sheet
Synonym:2,5-Diiodo-1,4-xylen

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
1124-08-91,4-Diiodo-2,5-dimethylbenzene97%unlisted
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.Light sensitive.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
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. Do not store in direct sunlight. 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# 1124-08-9: 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: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 103 - 104 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: C8H8I2
Molecular Weight: 358

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

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 1124-08-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1,4-Diiodo-2,5-dimethylbenzene - 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
No information available.
IMO
No information available.
RID/ADR
No information available.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
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 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 1124-08-9: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 1124-08-9 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 1124-08-9 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A