636-53-3 (间苯二甲酸二乙酯,Diethyl isophthalate)

CAS号:
636-53-3
中文名称:
间苯二甲酸二乙酯
英文名称:
Diethyl isophthalate
分子式:
C12H14O4
分子量:
222.237164020538

间苯二甲酸二乙酯(636-53-3)名称与标识符

名称

中文别名:
间苯二甲酸二乙酯;[5-(1-氨基-乙基)-4H-[1,2,4]噻唑-3-基]-乙酸盐酸盐;二乙基 异邻苯二甲酸酯;1,3-苯二甲酸二乙酯;特效溶剂DEIP;
英文别名:
Diethyl isophthalate;DEIP;1,3-Benzenedicarboxylic acid, diethyl ester;Isophthalic acid, diethyl ester;Diethyl m-phthalate;Diethyl isophthlate;E1QJK560FY;diethyl benzene-1,3-dicarboxylate;JLVWYWVLMFVCDI-UHFFFAOYSA-N;1,3-Benzenedicarboxylic acid, 1,3-diethyl ester;1,3-diethyl benzene-1,3-dicarboxylate;Diethylisophthalate;Isophthalic acid diethyl;Isophthalic acid diethylester;SY024509;UNII-E1QJK560FY;GS-3111;SCHEMBL110276;NSC249815;NS00035519;NSC-249815;A834453;Q27276756;DIETHYL ISOPHTHALATE [HSDB];MFCD01717556;BRN 2052705;DTXSID5027277;NSC 249815;I10253;EINECS 211-260-1;AKOS015890689;636-53-3;isophthalic acid diethyl ester;CS-W018868;FT-0624904;AMY30311;HSDB 5732;211-260-1;1,3Benzenedicarboxylic acid, diethyl ester;DTXCID007277;

标识符

MDL:
MFCD01717556
InChIKey:
JLVWYWVLMFVCDI-UHFFFAOYSA-N
Inchi:
1S/C12H14O4/c1-3-15-11(13)9-6-5-7-10(8-9)12(14)16-4-2/h5-8H,3-4H2,1-2H3
SMILES:
O(CC)C(C1C=CC=C(C(=O)OCC)C=1)=O
BRN:
2052705

间苯二甲酸二乙酯(636-53-3)物化性质

实验特性

  • LogP : 2.04000
  • PSA : 52.60000
  • 折射率 : 1.5080 (estimate)
  • 沸点 : 302°C at 760 mmHg
  • 熔点 : 11.5°C
  • 蒸气压 : No data available
  • 闪点 : No data available
  • 颜色与性状 : No data avaiable
  • 密度 : 1.1239

计算特性

  • 精确分子量 : 222.08900
  • 氢键供体数量 : 0
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 6
  • 同位素质量 : 222.089
  • 重原子数量 : 16
  • 复杂度 : 225
  • 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) : 2.9
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 52.6

间苯二甲酸二乙酯(636-53-3)国际标准相关数据

EINECS:
5732

间苯二甲酸二乙酯(636-53-3)海关数据

海关编码:
2917399090
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

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%

间苯二甲酸二乙酯(636-53-3)生产方法和用途

用途:
在采用巴斯夫工艺生产甲苯二异氰酸酯的过程中,被用作重溶剂

间苯二甲酸二乙酯(636-53-3)推荐厂家 更多厂家(48)

间苯二甲酸二乙酯(636-53-3)相关文献

间苯二甲酸二乙酯(636-53-3) MSDS

基础信息

Name:Diethyl isophthalate Material Safety Data Sheet
Synonym:
CAS:636-53-3
Section 1 - Chemical Product ? MSDS Name:Diethyl isophthalate Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
636-53-3Diethyl isophthalate211-260-1
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Not available.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
May cause 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.
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:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable 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:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 636-53-3: 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: Viscous liquid
Color: Not available.
Odor: mild odor - characteristic odor
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 166 deg C @10mmHg
Freezing/Melting Point: 12 deg C
Autoignition Temperature: Not available.
Flash Point: 163 deg C ( 325.40 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water: Insoluble.
Specific Gravity/Density: 1.123
Molecular Formula: C12H14O4
Molecular Weight: 222.24

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, carbon dioxide.
Hazardous Polymerization: Will not occur.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 636-53-3: NT2500000 LD50/LC50:
Not available.
Carcinogenicity:
Diethyl isophthalate - 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
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 636-53-3: No information available.
Canada
CAS# 636-53-3 is listed on Canada's NDSL List.
CAS# 636-53-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 636-53-3 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A