515-83-3 (2,2,2-三氯-1-乙氧基乙醇,2,2,2-trichloro-1-ethoxyethanol)

CAS号:
515-83-3
中文名称:
2,2,2-三氯-1-乙氧基乙醇
英文名称:
2,2,2-trichloro-1-ethoxyethanol
分子式:
C4H7Cl3O2
分子量:
193.45617890358

2,2,2-三氯-1-乙氧基乙醇(515-83-3)名称与标识符

名称

中文别名:
2,2,2-三氯-1-乙氧基乙醇;二乙醇縮氯醛;三氯-1-乙氧基乙醇;
英文别名:
2,2,2-trichloro-1-ethoxyethanol;2.2.2-Trichloro-1-ethoxyethanol;1-Aethoxy-2,2,2-trichlor-aethanol;1-ethoxy-2,2,2-trichloro-ethanol;2,2':6',2''-TERPYRIDINE-4'-PHOSPHONIC ACID;Chloral alcoholate;Chloral ethylalcoholate;Chloral semiacetal;Chloral,ethyl hemiacetal;Chloral-monoaethylacetal;Ethanol chloral hemiacetal;ETHANOL,2,2,2-TRICHLORO-1-ETHOXY;trichloroacetaldehyde ethyl hemiacetal;Trichloroacetaldehyde monoethylacetal;AKOS015918432;UNII-JU3I94Z61H;NSC 8411;Chloralalkoholat;NS00043571;SCHEMBL492511;2,2-Trichloro-1-ethoxyethanol;BRN 1209355;DTXSID90870577;NSC-8411;JU3I94Z61H;ETHANOL, 2,2,2-TRICHLORO-1-ETHOXY-;2,2,2-Trichloro-1-ethoxy ethanol;CHLORAL ALCOHOLATE, (+/-)-;MFCD00013668;NSC8411;WLN: GXGGYQO2;Q27281702;BP-13084;Chloral, ethyl hemiacetal;Ethanol,2,2-trichloro-1-ethoxy-;EINECS 208-211-1;Chloralalkoholat [Czech];FT-0607725;1-Ethoxy-2,2,2-trichloroethanol;515-83-3;2.2.2-trichloro-1-ethoxy ethanol;DLHWKJDYXPNWAI-UHFFFAOYSA-N;Ethanol, 1-ethoxy-2,2,2-trichloro-;CHLORAL ALCOHOLATE [MI];DTXCID00818288;G90002;DB-051993;4-01-00-03144 (Beilstein Handbook Reference);

标识符

MDL:
MFCD00013668
InChIKey:
DLHWKJDYXPNWAI-UHFFFAOYSA-N
Inchi:
1S/C4H7Cl3O2/c1-2-9-3(8)4(5,6)7/h3,8H,2H2,1H3
SMILES:
ClC(C(O)OCC)(Cl)Cl
BRN:
1209355

2,2,2-三氯-1-乙氧基乙醇(515-83-3)物化性质

实验特性

  • LogP : 1.71150
  • PSA : 29.46000
  • Merck : 14,2069
  • 折射率 : 1.488
  • 水溶性 : Slightly soluble in Water.
  • 沸点 : 116 °C
  • 熔点 : 47 °C
  • 闪点 : 116°C
  • 颜色与性状 : 固体结晶
  • 溶解性 : 溶于水、乙醇
  • 敏感性 : Hygroscopic
  • 密度 : 1,143 g/cm3

计算特性

  • 精确分子量 : 191.95100
  • 氢键供体数量 : 1
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 3
  • 同位素质量 : 191.951
  • 重原子数量 : 9
  • 复杂度 : 80.4
  • 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 : 1
  • 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) : 1.8
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 29.5A^2

2,2,2-三氯-1-乙氧基乙醇(515-83-3)安全信息

2,2,2-三氯-1-乙氧基乙醇(515-83-3)海关数据

海关编码:
2911000000
海关数据:

中国海关编码:

2911000000

概述:

2911000000 缩醛及半缩醛,不论是否含其他含氧基,及其卤化,磺化,硝化和亚硝化衍生物。监管条件:无。增值税率:17.0%。退税率:9.0%。最惠国关税:5.5%。普通关税:30.0%

申报要素:

品名, 成分含量, 用途

Summary:

2911000000 acetals and hemiacetals, whether or not with other oxygen function, and their halogenated, sulphonated, nitrated or nitrosated derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

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2,2,2-三氯-1-乙氧基乙醇(515-83-3)相关文献

2,2,2-三氯-1-乙氧基乙醇(515-83-3) MSDS

基础信息

Name:2 2 2-Trichloro-1-ethoxyethanol Material Safety Data Sheet
Synonym:Chloral alcoholate; Chloral ethyl hemiacetal; Chloral Ethylalcoholate; Trichloroacetaldehyde Monoethylacetal
CAS:515-83-3
Section 1 - Chemical Product ? MSDS Name:2 2 2-Trichloro-1-ethoxyethanol Material Safety Data Sheet
Synonym:Chloral alcoholate; Chloral ethyl hemiacetal; Chloral Ethylalcoholate; Trichloroacetaldehyde Monoethylacetal

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
515-83-32,2,2-Trichloro-1-ethoxyethanol100.0208-211-1
Hazard Symbols: XN
Risk Phrases: 22

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Harmful if swallowed.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
May cause respiratory tract irritation.
Chronic:
No information found.

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 immediately.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse.
Ingestion:
If victim is conscious and alert, give 2-4 cupfuls of milk or water.
Never give anything by mouth to an unconscious person. Get medical aid.
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:
Antidote: None reported.

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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Clean up spills immediately, observing precautions in the Protective Equipment section. Sweep up or absorb material, then place into a suitable clean, dry, closed container for disposal. Avoid generating dusty conditions. Provide ventilation.

Section 7 - HANDLING and STORAGE
? Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
Storage:
Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
? Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 515-83-3: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
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: Crystals
Color: Not available.
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 116 deg C
Freezing/Melting Point: 47.5 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: Slightly soluble.
Specific Gravity/Density:
Molecular Formula: C4H7Cl3O2
Molecular Weight: 193.46

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, dust generation, strong oxidants.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Irritating and toxic fumes and gases, chloride fumes.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 515-83-3: KM4725000 LD50/LC50:
CAS# 515-83-3: Oral, rat: LD50 = 880 mg/kg.
Carcinogenicity:
2,2,2-Trichloro-1-ethoxyethanol - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

Section 12 - ECOLOGICAL INFORMATION
? Other No information available.

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: XN
Risk Phrases:
R 22 Harmful if swallowed.
Safety Phrases:
S 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 515-83-3: No information available.
Canada
CAS# 515-83-3 is listed on Canada's NDSL List.
CAS# 515-83-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 515-83-3 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A