2-溴-4,5-二氯咪唑,16076-27-0，生产厂家，价格-洛克化工网移动版

2-溴-4,5-二氯咪唑

中文名称：: 2-溴-4,5-二氯咪唑

中文别名：: 2-溴-4,5-二氯咪唑;
2-溴-4,5-二氯-1H-咪唑

英文名称：: 1H-Imidazole,2-bromo-4,5-dichloro-

英文别名：: 2-Bromo-4,5-dichloro-1H-imidazole;
Imidazole,2-bromo-4,5-dichloro;
Imidazole,5-dichloro;
1H-Imidazole,2-bromo-4,5-dichloro;
2-Brom-4,5-dichlorimidazol;
2-Bromo-4,5-dichloroimidazole;
2-bromo-4,5-dichloro-imidazole

CAS No.：: 16076-27-0

分子式：: C₃HBrCl₂N₂

分子量：: 215.86

精确分子量：: 213.87000

PSA：: 28.68000

MDL：: MFCD00067894

EINECS：: 000-000-0

BRN：: 606732

InChI：: InChI=1/C3HBrCl2N2/c4-3-7-1(5)2(6)8-3/h(H,7,8)3

危险品标志：: XiXn

风险术语：: R20/21/22;R36/37/38;

安全术语：: S26;S36/37/39 ;

分子结构式：

SDS：: 查看

2-溴-4,5-二氯咪唑制备方法及用途

制备方法

用作医药中间体

用途简介

用途

用作医药中间体

2-溴-4,5-二氯咪唑物化性质

外观与性状：: 白色晶体或粉末
密度：: 2.135 g/cm3
熔点：: 223 °C (dec.)(lit.)
沸点：: 350.8ºC at 760 mmHg
闪点：: 166ºC
折射率：: 1.636
蒸汽压：: 4.29E-05mmHg at 25°C
其它信息：: 1. 性状：白色结晶或粉末

2. 密度（g/mL,25/4℃）：未确定

3. 相对蒸汽密度（g/mL,空气=1）：未确定

4. 熔点（ºC）：223

5. 沸点（ºC,常压）：未确定

6. 沸点（ºC,5.2kPa）：未确定

7. 折射率：未确定

8. 闪点（ºC）：未确定

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：未确定

17. 爆炸上限（%,V/V）：未确定

18. 爆炸下限（%,V/V）：未确定

19. 溶解性：未确定

2-溴-4,5-二氯咪唑安全信息

海关代码：: 2933290090
WGK_Germany：: 3
德国有关水污染物质的分类清单
危险类别码：: R20/21/22;R36/37/38
安全说明：: S26-S36-S36/37/39
RTECS号：: NI3517500
安全标志：: S26:万一接触眼睛，立即使用大量清水冲洗并送医诊治。
S36:穿戴合适的防护服装。
危险标志：: Xn:Harmful;

2-溴-4,5-二氯咪唑毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NI3517500

CHEMICAL NAME :: Imidazole, 2-bromo-4,5-dichloro-

CAS REGISTRY NUMBER :: 16076-27-0

BEILSTEIN REFERENCE NO. :: 0606732

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C3-H-Br-Cl2-N2

MOLECULAR WEIGHT :: 215.87

WISWESSER LINE NOTATION :: T5M CNJ BE DG EG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 10 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#05098

毒理学数据：: 急性毒性：大鼠静脉LD5：10 mg/kg

2-溴-4,5-二氯咪唑 MSDS

Name:	2-Bromo-4 5-dichloro-1h-imidazole 97% Material Safety Data Sheet
Synonym:
CAS:	16076-27-0

Section 1 - Chemical Product MSDS Name:2-Bromo-4 5-dichloro-1h-imidazole 97% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
16076-27-0	2-Bromo-4,5-dichloro-1H-imidazole	97%	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.
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# 16076-27-0: 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: off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 215 - 216 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: C3HBrCl2N2
Molecular Weight: 216

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Acids, oxidizing agents, reducing agents, acid chlorides, bases.
Hazardous Decomposition Products:
Hydrogen chloride, chlorine, nitrogen oxides, carbon monoxide, carbon dioxide, hydrogen bromide, bromine.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 16076-27-0: NI3517500 LD50/LC50:
Not available.
Carcinogenicity:
2-Bromo-4,5-dichloro-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 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# 16076-27-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 16076-27-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 16076-27-0 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A

2-溴-4,5-二氯咪唑海关数据

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
摘要/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-溴-4,5-二氯咪唑分子结构与计算化学数据

分子结构数据

分子性质数据：

1、摩尔折射率：36.25

2、摩尔体积（m³/mol）：101.0

3、等张比容（90.2K）：283.2

4、表面张力（dyne/cm）：61.7

5、极化率（10^-24cm³）：14.37

计算化学数据

1.疏水参数计算参考值（XlogP）:无

2.氢键供体数量:1

3.氢键受体数量:1

4.可旋转化学键数量:0

5.互变异构体数量:无

6.拓扑分子极性表面积28.7

7.重原子数量:8

8.表面电荷:0

9.复杂度:91.4

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

2-溴-4,5-二氯咪唑上游产品

4,5-二氯咪唑

2-溴-4,5-二氯咪唑下游产品

1H-咪唑, 2-溴-4,5-二氯-1-[(环丙基甲氧基)甲基]- 2-bromo-4,5-dichloro-1-(propan-2-yloxymethyl)imidazole 2-溴-4,5-二氯-1-(丙氧基甲基)-1H-咪唑