2,5-Dibromo-3-methylthiophene
- 中文别名:2,5-二溴-3-甲基噻吩
- 中文释义:2,5-二溴-3-甲基噻吩;3-甲基-2,5-二溴噻吩
- 英文别名:2,5-DIBROMO-3-METHYLTHIOPHENE;
2,5-dibromo-3-methyl-thiophene;
2-(p-Nitrophenylthio)ethanol;
3-methyl-2,5-dibromothiophene;
2,5-Dibrom-3-methyl-thiophen;
2,4-DICHLORO-N'-(2-CHLOROACETYL)BENZENECARBOHYDRAZIDE;
2,5-dibromo-3-methylthiophen
- CAS No.:13191-36-1
- 分子式:C5H4Br2S
- 分子量:255.96
- 精确分子量:253.84000
- PSA:28.24000
- MDL:MFCD00015470
- InChI:InChI=1/C5H4Br2S/c1-3-2-4(6)8-5(3)7/h2H,1H3
- 分子结构式:
物化性质
- 密度:
- 1.972
- 沸点:
- 230.2ºC at 760mmHg
- 闪点:
- 93ºC
- 折射率:
- 1.613
- 蒸汽压:
- 0.101mmHg at 25°C
- 存储条件/存储方法:
常温密闭,阴凉通风干燥
- 稳定性相关:
常温常压下稳定
避免的物料 氧化物 光- 其它信息:
1. 性状:灰黄色液体
2. 密度(g/mL,25℃):1.972
3. 相对蒸汽密度(g/mL,空气=1):未确定
4. 熔点(ºC):未确定
5. 沸点(ºC,常压):226-230
6. 沸点(ºC,5mmHg):未确定
7. 折射率:1.6130
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(20ºC):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
安全信息
- 密度:
- 1.972
- 沸点:
- 230.2ºC at 760mmHg
- 闪点:
- 93ºC
- 折射率:
- 1.613
- 蒸汽压:
- 0.101mmHg at 25°C
- 存储条件/存储方法:
常温密闭,阴凉通风干燥
- 稳定性相关:
常温常压下稳定
避免的物料 氧化物 光- 其它信息:
1. 性状:灰黄色液体
2. 密度(g/mL,25℃):1.972
3. 相对蒸汽密度(g/mL,空气=1):未确定
4. 熔点(ºC):未确定
5. 沸点(ºC,常压):226-230
6. 沸点(ºC,5mmHg):未确定
7. 折射率:1.6130
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(20ºC):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
毒理性
- 毒理学数据:
主要的刺激性影响:
在皮肤上面:刺激皮肤和粘膜
在眼睛上面:刺激的影响
致敏作用:没有已知的敏化现象
- 生态数据:
通常对水是不危害的,若无政府许可,勿将材料排入周围环境
MSDS
2,5-Dibromo-3-methylthiopheneRevision number: 5
SAFETY DATA SHEET
Section1. IDENTIFICATION
Product name:2,5-Dibromo-3-methylthiophene
Revision number:5
Section2. HAZARDS IDENTIFICATION
GHS classification
PHYSICAL HAZARDSNot classified
HEALTH HAZARDS
Skin corrosion/irritationCategory 2
Category 2A
Serious eye damage/eye irritation
ENVIRONMENTAL HAZARDSNot classified
GHS label elements, including precautionary statements
Pictograms or hazard symbols
Signal wordWarning
Hazard statementsCauses skin irritation
Causes serious eye irritation
Precautionary statements:
Wash hands thoroughly after handling.
[Prevention]
Wear protective gloves/eye protection/face protection.
IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses,
[Response]
if present and easy to do. Continue rinsing.
If eye irritation persists: Get medical advice/attention.
IF ON SKIN: Gently wash with plenty of soap and water.
If skin irritation occurs: Get medical advice/attention.
Take off contaminated clothing and wash before reuse.
Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Substance/mixture:Substance
Components:2,5-Dibromo-3-methylthiophene
Percent:>98.0%(GC)
CAS Number:13191-36-1
Chemical Formula:C5H4Br2S
Section4. FIRST AID MEASURES
Inhalation:Remove victim to fresh air and keep at rest in a position comfortable for breathing.
Get medical advice/attention if you feel unwell.
2,5-Dibromo-3-methylthiophene
Section4. FIRST AID MEASURES
Skin contact:Remove/Take off immediately all contaminated clothing. Gently wash with plenty of
soap and water. If skin irritation or rash occurs: Get medical advice/attention.
Eye contact:Rinse cautiously with water for several minutes. Remove contact lenses, if present
and easy to do. Continue rinsing. If eye irritation persists: Get medical
advice/attention.
Ingestion:Get medical advice/attention if you feel unwell. Rinse mouth.
A rescuer should wear personal protective equipment, such as rubber gloves and air-
Protection of first-aiders:
tight goggles.
Section5. FIRE-FIGHTING MEASURES
Suitable extinguishingDry chemical, foam, water spray, carbon dioxide.
media:
Unsuitable extinguishing Solid streams of water
media:
Specific hazards arising Take care as it may decompose upon combustion or in high temperatures to
from the chemical:generate poisonous fume.
Precautions for firefighters: Fire-extinguishing work is done from the windward and the suitable fire-extinguishing
method according to the surrounding situation is used. Uninvolved persons should
evacuate to a safe place. In case of fire in the surroundings: Remove movable
containers if safe to do so.
Special protectiveWhen extinguishing fire, be sure to wear personal protective equipment.
equipment for firefighters:
Section6. ACCIDENTAL RELEASE MEASURES
Personal precautions,Use personal protective equipment. Keep people away from and upwind of spill/leak.
protective equipment and Ensure adequate ventilation. Entry to non-involved personnel should be controlled
emergency procedures: around the leakage area by roping off, etc.
Environmental precautions: Prevent product from entering drains.
Methods and materials for Absorb spilled material in a suitable absorbent (e.g. rag, dry sand, earth, saw-dust).
containment and cleaning In case of large amount of spillage, contain a spill by bunding. Adhered or collected
up: material should be promptly disposed of, in accordance with appropriate laws and
regulations.
Section7. HANDLING AND STORAGE
Precautions for safe handling
Technical measures:Handling is performed in a well ventilated place. Wear suitable protective equipment.
Prevent generation of vapour or mist. Wash hands and face thoroughly after
handling.
Use a ventilation, local exhaust if vapour or aerosol will be generated.
Advice on safe handling: Avoid contact with skin, eyes and clothing.
Conditions for safe storage, including any
incompatibilities
Storage conditions:Keep container tightly closed. Store in a refrigerator.
Store away from incompatible materials such as oxidizing agents.
Heat-sensitive, Light-sensitive
Packaging material:Comply with laws.
Section8. EXPOSURE CONTROLS / PERSONAL PROTECTION
Engineering controls:Install a closed system or local exhaust as possible so that workers should not be
exposed directly. Also install safety shower and eye bath.
Personal protective equipment
Respiratory protection: Vapor respirator. Follow local and national regulations.
Protective gloves.
Hand protection:
Eye protection:Safety glasses. A face-shield, if the situation requires.
Skin and body protection: Protective clothing. Protective boots, if the situation requires.
2,5-Dibromo-3-methylthiophene
Section9. PHYSICAL AND CHEMICAL PROPERTIES
Physical state (20°C):Liquid
Form:Clear
Pale yellow - Yellow
Colour:
Odour:No data available
pH: No data available
Melting point/freezing point:No data available
108°C/2.3kPa
Boiling point/range:
Flash point:No data available
Flammability or explosive
limits:
No data available
Lower:
Upper:No data available
1.99
Relative density:
Solubility(ies):
No data available
[Water]
[Other solvents]No data available
4.14
Log Pow:
Section10. STABILITY AND REACTIVITY
Chemical stability:Stable under proper conditions.
Possibility of hazardous No special reactivity has been reported.
reactions:
Incompatible materials: Oxidizing agents
Hazardous decomposition Carbon monoxide, Carbon dioxide, Sulfur oxides, Hydrogen bromide
products:
Section11. TOXICOLOGICAL INFORMATION
No data available
Acute Toxicity:
Skin corrosion/irritation: No data available
No data available
Serious eye
damage/irritation:
Germ cell mutagenicity: No data available
Carcinogenicity:
No data available
IARC =
NTP =No data available
No data available
Reproductive toxicity:
Section12. ECOLOGICAL INFORMATION
Ecotoxicity:
Fish:No data available
Crustacea:No data available
Algae:No data available
Persistence / degradability: No data available
BioaccumulativeNo data available
potential(BCF):
Mobility in soil
Log Pow:4.14
Soil adsorption (Koc):No data available
Henry's LawNo data available
constant(PaM3/mol):
Section13. DISPOSAL CONSIDERATIONS
Recycle to process, if possible. Consult your local regional authorities. You may be able to burn in a chemical
incinerator equipped with an afterburner and scrubber system. Observe all federal, state and local regulations when
disposing of the substance.
2,5-Dibromo-3-methylthiophene
Section14. TRANSPORT INFORMATION
Hazards Class:Does not correspond to the classification standard of the United Nations
UN-No:Not listed
Section15. REGULATORY INFORMATION
Safe management ordinance of dangerous chemical product (State Council announces on January 26, 2002
and revised on February 16,2011): Safe use and production, the storage of a dangerous chemical, transport,
loading and unloading were prescribed.
SECTION 16 - ADDITIONAL INFORMATION
N/A
海关数据
中国海关编码:2934999090
- 概述:
- 2934999090. 其他杂环化合物. 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
- 摘要/Summary:
- 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
分子结构与计算化学数据
分子结构数据
1、 摩尔折射率:44.84
2、 摩尔体积(m3/mol):127.5
3、 等张比容(90.2K):329.0
4、 表面张力(dyne/cm):44.2
5、 极化率(10-24cm3):17.77
计算化学数据
1.疏水参数计算参考值(XlogP):4
2.氢键供体数量:0
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28.2
7.重原子数量:8
8.表面电荷:0
9.复杂度:86.5
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