67-36-7 (4-苯氧基苯甲醛,4-Phenoxybenzaldehyde)

CAS号:
67-36-7
中文名称:
4-苯氧基苯甲醛
英文名称:
4-Phenoxybenzaldehyde
分子式:
C13H10O2
分子量:
198.217303752899

4-苯氧基苯甲醛(67-36-7)名称与标识符

名称

中文别名:
4-苯氧基苯甲醛;对苯氧基苯甲醛;4-Phenoxybenzaldehyde 4-苯氧基苯甲醛;
英文别名:
4-Phenoxybenzaldehyde;4-Formyldiphenyl ether;4-OPhC6H4CHO;4-Phenoxy-benzaldehyde;4-phenyloxybenzaldehyde;4-PhOC6H4-CHO;Benzaldehyde,4-phenoxy;Benzaldehyde,p-phenoxy;EINECS 200-650-7;para-phenoxy benzaldehyde;p-phenoxybenzaldehyde;Benzaldehyde,p-phenoxy- (6CI,7CI,8CI);Benzaldehyde, 4-phenoxy-;Benzaldehyde, p-phenoxy-;4-(phenyloxy)benzaldehyde;QWLHJVDRPZNVBS-UHFFFAOYSA-N;58H5VR8362;Diphenyl Ether 4-Carboxaldehyde;zlchem 548;4-Formyldiphenylether;4-phenoxy benzaldehyde;PubChem13138;FT-0619367;P1333;Z104479070;DTXSID7021730;AI3-62192;4-08-00-00257 (Beilstein Handbook Reference);Q27261597;STR03366;4-Phenoxybenzaldehyde, 98%;AR1919;AC-17852;EN300-20594;67-36-7;AMY8793;A835723;4-PHENOXYBENZENECARBOXALDEHYDE;LS-25139;PS-8240;SCHEMBL97639;BRN 1947841;MFCD00003383;CS-W001949;W-104718;AKOS000260361;4-phenoxybenzaldehyd;CHEMBL1933309;UNII-58H5VR8362;SY003245;NS00022649;DTXCID401730;4-Phenoxy-benzaldehyde; p-Phenoxy-benzaldehyde; 4-Formyldiphenyl Ether; 4-Phenoxybenzenecarboxaldehyde; p-Phenoxybenzaldehyde;4-Formyldiphenyl ether;Diphenyl ether 4-carboxaldehyde;FP52864;

标识符

MDL:
MFCD00003383
InChIKey:
QWLHJVDRPZNVBS-UHFFFAOYSA-N
Inchi:
1S/C13H10O2/c14-10-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h1-10H
SMILES:
O(C1C=CC=CC=1)C1C=CC(C=O)=CC=1
BRN:
1947841

4-苯氧基苯甲醛(67-36-7)物化性质

实验特性

  • LogP : 3.29140
  • PSA : 26.30000
  • 折射率 : n20/D 1.611(lit.)
  • 水溶性 : Insoluble in water.
  • 沸点 : 185 °C/14 mmHg(lit.)
  • 熔点 : 24-25 °C (lit.)
  • 闪点 : 华氏:230 °F
    摄氏:110 °C
  • 颜色与性状 : White to Yellow Solid
  • 溶解性 : 不确定
  • 敏感性 : Air Sensitive
  • 密度 : 1.132 g/mL at 25 °C(lit.)

计算特性

  • 精确分子量 : 198.06800
  • 氢键供体数量 : 0
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 3
  • 同位素质量 : 198.068
  • 重原子数量 : 15
  • 复杂度 : 189
  • 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) : 3.2
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 26.3

4-苯氧基苯甲醛(67-36-7)国际标准相关数据

EINECS:
200-650-7

4-苯氧基苯甲醛(67-36-7)海关数据

海关编码:
2912499000
海关数据:

中国海关编码:

2912499000

概述:

2912499000. 其他醛醚、醛酚及含其他含氧基的醛. 增值税率:17.0%. 退税率:9.0%. 监管条件:无. 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, 四聚甲醛报明外观

Summary:

2912499000. other aldehyde-ethers, aldehyde-phenols and aldehydes with other oxygen function. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:5.5%. General tariff:30.0%

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4-苯氧基苯甲醛(67-36-7)相关文献

4-苯氧基苯甲醛(67-36-7)参考资料

Reaxys RN:
1947841
Beilstein:
8(4)257
PubChem CID:

4-苯氧基苯甲醛(67-36-7) MSDS

基础信息

Name:4-Phenoxybenzaldehyde 98% Material Safety Data Sheet
Synonym:Benzaldehyde,4-phenoxy; 4-formyldiphenylether; p-phenoxybenzaldehyd
CAS:67-36-7
Section 1 - Chemical Product ? MSDS Name:4-Phenoxybenzaldehyde 98% Material Safety Data Sheet
Synonym:Benzaldehyde,4-phenoxy; 4-formyldiphenylether; p-phenoxybenzaldehyd

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
67-36-74-Phenoxybenzaldehyde98200-650-7
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
No information regarding eye irritation and other potential effects was found.
Skin:
No information regarding skin irritation and other potential effects was found.
Ingestion:
May cause digestive tract disturbances. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated.
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 immediately.
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:

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:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. 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. Provide ventilation.

Section 7 - HANDLING and STORAGE
? Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. 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# 67-36-7: 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: Liquid
Color: clear colorless to yellow
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 185 deg C
Freezing/Melting Point: 24.00 - 25.00 deg C
Autoignition Temperature: Not available.
Flash Point: > 112 deg C (> 233.60 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: 1.1320g/cm3
Molecular Formula: C13H10O2
Molecular Weight: 198.22

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:
Oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 67-36-7: CU7560000 LD50/LC50:
Not available.
Carcinogenicity:
4-Phenoxybenzaldehyde - 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.
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# 67-36-7: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 67-36-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 67-36-7 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A