1,3,5-Triazine-2,4,6-tricarboxylicacid, 2,4,6-triethyl ester
- 中文别名:1,3,5-三嗪-2,4,6-三甲酸三乙酯
- 中文释义:1,3,5-三嗪-2,4,6-三甲酸三乙酯;1,3,5三乙酯三嗪-2,4,6-三羧酸
- 英文别名:triethyl 1,3,5-triazine-2,4,6-tricarboxylate;
triethyl s-triazine-2,4,6-tricarboxylate;
[1,3,5]triazine-2,4,6-tricarboxylic acid triethyl ester;
[1,3,5]Triazin-2,4,6-tricarbonsaeure-triaethylester;
2,4,6-Triethoxycarbonyl-1,3,5-triazine;
2,4,6-tris(ethoxycarbonyl)-1,3,5-triazine
- CAS No.:898-22-6
- 分子式:
C12H15N3O6
- 分子量:297.26
- 精确分子量:297.09600
- PSA:117.57000
- MDL:MFCD01419268
- InChI:The Key: LKNPNZKIOSOWES-UHFFFAOYSA-N
- 分子结构式:
物化性质
- 密度:
- 1.279g/cm3
- 熔点:
- 170-174ºC(lit.)
- 沸点:
- 451.1ºC at 760 mmHg
- 闪点:
- 226.6ºC
- 折射率:
- 1.512
- 存储条件/存储方法:
常温 , 避光,通风干燥处
- 稳定性相关:
常温常压下稳定
- 其它信息:
1. 性状:未确定
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):170-174
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
安全信息
- 密度:
- 1.279g/cm3
- 熔点:
- 170-174ºC(lit.)
- 沸点:
- 451.1ºC at 760 mmHg
- 闪点:
- 226.6ºC
- 折射率:
- 1.512
- 存储条件/存储方法:
常温 , 避光,通风干燥处
- 稳定性相关:
常温常压下稳定
- 其它信息:
1. 性状:未确定
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):170-174
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
毒理性
- 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
Section1. IDENTIFICATION OF THE SUBSTANCE/MIXTURE
Product name: Triethyl 1,3,5-triazine-2,4,6-tricarboxylate
Section2. HAZARDS IDENTIFICATION
Classification of the substance or mixture
Not a dangerous substance according to GHS.
This substance is not classified as dangerous according to Directive 67/548/EEC.
Label elements
The product does not need to be labelled in accordance with EC directives or respective national laws.
Other hazards - none
Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Formula: C12H15N3O6
Molecular Weight: 297,26 g/mol
CAS-No.EC-No.Index-No.ClassificationConcentration
Triethyl-1,3,5-triazine-2,4,6-tricarboxylate
898-22-6----
Section4. FIRST AID MEASURES
If inhaled
If breathed in, move person into fresh air. If not breathing give artificial respiration
In case of skin contact
Wash off with soap and plenty of water.
In case of eye contact
Flush eyes with water as a precaution.
If swallowed
Never give anything by mouth to an unconscious person. Rinse mouth with water.
Section5. FIRE-FIGHTING MEASURES
Suitable extinguishing media
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
Special protective equipment for fire-fighters
Wear self contained breathing apparatus for fire fighting if necessary.
Section6. ACCIDENTAL RELEASE MEASURES
Personal precautions
Avoid dust formation.
Environmental precautions
Do not let product enter drains.
Methods and materials for containment and cleaning up
Sweep up and shovel. Keep in suitable, closed containers for disposal.
Section7. HANDLING AND STORAGE
Precautions for safe handling
Provide appropriate exhaust ventilation at places where dust is formed. Normal measures for preventive fire
protection.
Conditions for safe storage
Store in cool place. Keep container tightly closed in a dry and well-ventilated place.
Section8. EXPOSURE CONTROLS/PERSONAL PROTECTION
Personal protective equipment
Respiratory protection
Respiratory protection is not required. Where protection from nuisance levels of dusts are desired, use
type N95 (US) or type P1 (EN 143) dust masks. Use respirators and components tested and approved
under appropriate government standards such as NIOSH (US) or CEN (EU).
Hand protection
For prolonged or repeated contact use protective gloves.
Eye protection
Safety glasses
Hygiene measures
General industrial hygiene practice.
Section9. PHYSICAL AND CHEMICAL PROPERTIES
Appearance
Formsolid
Safety data
pH no data available
Melting point170 - 174 °C - lit.
Boiling pointno data available
Flash pointno data available
Ignition temperature no data available
Lower explosion limit no data available
Upper explosion limit no data available
Water solubilityno data available
Section10. STABILITY AND REACTIVITY
Chemical stability
Stable under recommended storage conditions.
Conditions to avoid
no data available
Materials to avoid
Strong oxidizing agents
Hazardous decomposition products
Hazardous decomposition products formed under fire conditions. - Carbon oxides, nitrogen oxides (NOx)
Section11. TOXICOLOGICAL INFORMATION
Acute toxicity
no data available
Skin corrosion/irritation
no data available
Serious eye damage/eye irritation
no data available
Respiratory or skin sensitization
no data available
Germ cell mutagenicity
no data available
Carcinogenicity
IARC: No component of this product present at levels greater than or equal to 0.1% is identified as
probable, possible or confirmed human carcinogen by IARC.
Reproductive toxicity
no data available
Specific target organ toxicity - single exposure
no data available
Specific target organ toxicity - repeated exposure
no data available
Aspiration hazard
no data available
Potential health effects
InhalationMay be harmful if inhaled. May cause respiratory tract irritation.
IngestionMay be harmful if swallowed.
SkinMay be harmful if absorbed through skin. May cause skin irritation.
Eyes
May cause eye irritation.
Signs and Symptoms of Exposure
To the best of our knowledge, the chemical, physical, and toxicological properties have not been thoroughly
investigated.
Additional Information
RTECS: no data available
Section12. ECOLOGICAL INFORMATION
Toxicity
no data available
Persistence and degradability
no data available
Bioaccumulative potential
no data available
Mobility in soil
no data available
PBT and vPvB assessment
no data available
Other adverse effects
no data available
Section13. DISPOSAL CONSIDERATIONS
Product
Observe all federal, state, and local environmental regulations.
Contaminated packaging
Dispose of as unused product.
Section14. TRANSPORT INFORMATION
ADR/RID
Not dangerous goods
IMDG
Not dangerous goods
IATA
Not dangerous goods
SECTION 15 - REGULATORY INFORMATION
N/A
SECTION 16 - ADDITIONAL INFORMATION
N/A
海关数据
中国海关编码:2933699090
- 概述:
- 2933699090 其他结构上含非稠合三嗪环化合物. 增值税率:17.0% 退税率:9.0% 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:
- 2933699090 other compounds containing an unfused triazine ring (whether or not hydrogenated) in the structure。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:20.0%
分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):1.6
2.氢键供体数量:0
3.氢键受体数量:9
4.可旋转化学键数量:9
5.互变异构体数量:无
6.拓扑分子极性表面积118
7.重原子数量:21
8.表面电荷:0
9.复杂度:320
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