1,4-Benzenedicarboxylicacid, 1,4-di-2-propen-1-yl ester
- 中文别名:对苯二甲酸二丙烯酯
- 中文释义:对苯二甲酸二丙烯酯;对苯二甲酸二烯丙酯
- 英文别名:bis(prop-2-enyl) benzene-1,4-dicarboxylate;
Diallyl terephthalate;
p-CH2CHCH2OOCC6H4COOCH2CHCH2;
terephthalic acid diallyl ester;
Terephthalsaeure-diallylester;
1,4-Benzenedicarboxylic acid,di-2-propenyl ester;
Diallyl terethiolate;
Diallylterephthalat
- CAS No.:1026-92-2
- 分子式:
C14H14O4
- 分子量:246.26
- 精确分子量:246.08900
- PSA:52.60000
- InChI:The Key: ZDNFTNPFYCKVTB-UHFFFAOYSA-N
- 分子结构式:
物化性质
- 密度:
- 1.112g/cm3
- 沸点:
- 349.9ºC at 760mmHg
- 闪点:
- 171.3ºC
- 折射率:
- 1.524
- 蒸汽压:
- 4.56E-05mmHg at 25°C
- 其它信息:
1.性状:未确定。
2.密度(g/cm3,25℃):1.1213.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):未确定6.沸点(ºC,8mm):176-1787.折射率(n20/D):未确定8.闪点(ºC):1719.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:
- 1.112g/cm3
- 沸点:
- 349.9ºC at 760mmHg
- 闪点:
- 171.3ºC
- 折射率:
- 1.524
- 蒸汽压:
- 4.56E-05mmHg at 25°C
- 其它信息:
1.性状:未确定。
2.密度(g/cm3,25℃):1.1213.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):未确定6.沸点(ºC,8mm):176-1787.折射率(n20/D):未确定8.闪点(ºC):1719.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
MSDS
Diallyl TerephthalateRevision number: 5
SAFETY DATA SHEET
Section1. IDENTIFICATION
Product name:Diallyl Terephthalate
Revision number:5
Section2. HAZARDS IDENTIFICATION
GHS classification
PHYSICAL HAZARDSNot classified
HEALTH HAZARDS
Acute toxicity (Oral)Category 4
Category 2
Skin corrosion/irritation
Serious eye damage/eye irritationCategory 2A
Not classified
ENVIRONMENTAL HAZARDS
GHS label elements, including precautionary statements
Pictograms or hazard symbols
Signal wordWarning
Hazard statementsHarmful if swallowed
Causes skin irritation
Causes serious eye irritation
Precautionary statements:
Do not eat, drink or smoke when using this product.
[Prevention]
Wash hands thoroughly after handling.
Wear protective gloves/eye protection/face protection.
[Response]IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell.
Rinse mouth.
IF IN EYES: 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.
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.
[Disposal]Dispose of contents/container through a waste management company authorized by
the local government.
Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Substance/mixture:Substance
Components:Diallyl Terephthalate
>98.0%(GC)
Percent:
CAS Number:1026-92-2
Diallyl Terephthalate
Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Synonyms:Terephthalic Acid Diallyl Ester
Chemical Formula:C14H14O4
Section4. FIRST AID MEASURES
Remove victim to fresh air and keep at rest in a position comfortable for breathing.
Inhalation:
Get medical advice/attention if you feel unwell.
Remove/Take off immediately all contaminated clothing. Gently wash with plenty of
Skin contact:
soap and water. If skin irritation or rash occurs: Get medical advice/attention.
Rinse cautiously with water for several minutes. Remove contact lenses, if present
Eye contact:
and easy to do. Continue rinsing. If eye irritation persists: Get medical
advice/attention.
Ingestion:Call a POISON CENTER or doctor/physician if you feel unwell. Rinse mouth.
Protection of first-aiders:A rescuer should wear personal protective equipment, such as rubber gloves and air-
tight goggles.
Section5. FIRE-FIGHTING MEASURES
Suitable extinguishingDry chemical, foam, water spray, carbon dioxide.
media:
Unsuitable extinguishing Solid streams of water
media:
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
Use personal protective equipment. Keep people away from and upwind of spill/leak.
Personal precautions,
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.
Diallyl Terephthalate
Section8. EXPOSURE CONTROLS / PERSONAL PROTECTION
Hand protection:Protective gloves.
Eye protection:Safety glasses. A face-shield, if the situation requires.
Skin and body protection: Protective clothing. Protective boots, if the situation requires.
Section9. PHYSICAL AND CHEMICAL PROPERTIES
Physical state (20°C):Liquid
Clear
Form:
Colour:Colorless - Very pale yellow
Odour:No data available
pH: No data available
Melting point/freezing point:No data available
Boiling point/range:172°C/0.7kPa
Flash point:158°C
Flammability or explosive
limits:
Lower:No data available
Upper:No data available
Relative density:1.12
Solubility(ies):
[Water]No data available
[Other solvents]No data available
Section10. STABILITY AND REACTIVITY
Stable under proper conditions.
Chemical stability:
Possibility of hazardous No special reactivity has been reported.
reactions:
Incompatible materials: Oxidizing agents
Hazardous decomposition Carbon monoxide, Carbon dioxide
products:
Section11. TOXICOLOGICAL INFORMATION
Acute Toxicity:No data available
Skin corrosion/irritation: No data available
Serious eyeNo data available
damage/irritation:
Germ cell mutagenicity: No data available
Carcinogenicity:
IARC =No data available
NTP =No data available
Reproductive toxicity:No data available
Section12. ECOLOGICAL INFORMATION
Ecotoxicity:
Fish:No data available
No data available
Crustacea:
Algae:No data available
Persistence / degradability: No data available
BioaccumulativeNo data available
potential(BCF):
Mobility in soil
Log Pow:No data available
Soil adsorption (Koc):No data available
No data available
Henry's Law
constant(PaM3/mol):
Diallyl Terephthalate
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.
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:2917399090
- 概述:
- 2917399090 其他芳香多元羧酸. 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:30.0%
- 申报要素:
- 品名, 成分含量, 用途, 对苯二甲酸请注明4-CBA值, 对苯二甲酸请注明P-TL酸值, 对苯二甲酸请注明色度, 对苯二甲酸请注明水分
- 摘要/Summary:
- 2917399090 aromatic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%
分子结构与计算化学数据
分子结构数据
1、摩尔折射率:67.78
2、摩尔体积(m3/mol):221.43、等张比容(90.2K):554.14、表面张力(dyne/cm):39.25、介电常数:无可用6、偶极距(10-24cm3):无可用7、极化率:26.87
计算化学数据
1.疏水参数计算参考值(XlogP):2.9
2.氢键供体数量:0
3.氢键受体数量:4
4.可旋转化学键数量:8
5.互变异构体数量:无
6.拓扑分子极性表面积52.6
7.重原子数量:18
8.表面电荷:0
9.复杂度:282
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