15547-89-4 (2-(3-甲氧基苯基)环己酮,2-(3-Methoxyphenyl)cyclohexanone)

CAS号:
15547-89-4
中文名称:
2-(3-甲氧基苯基)环己酮
英文名称:
2-(3-Methoxyphenyl)cyclohexanone
分子式:
C13H16O2
分子量:
204.264944076538

2-(3-甲氧基苯基)环己酮(15547-89-4)名称与标识符

名称

中文别名:
2-(3-甲氧基苯基)环己酮;2-(3-甲氧基苯基)环己酮, tech.;(2-萘甲基)溴化锌;
英文别名:
2-(3-Methoxyphenyl)cyclohexanone;2-(3-methoxyphenyl)cyclohexan-1-one;(+/-)-2-(3-methoxyphenyl)cyclohexanone;2-(3-methoxyphenyl)-cyclohexanon;2-(3-methoxyphenyl)-cyclohexanone;2-(3-methoxy-phenyl)-cyclohexanone;2-(m-methoxyphenyl)cyclohexanone;371270_ALDRICH;AC1L3AE8;AC1Q6KSR;ACMC-20aoq7;Cyclohexanone, 2-(3-methoxyphenyl)-;SureCN182434;15547-89-4;DTXSID60874441;EINECS 239-602-5;A809646;2-(3-Methoxyphenyl) cyclohexanone;EN300-1153077;NS00052608;2-(3-Methoxyphenyl)cyclohexanone, technical grade, 90%;CS-0303083;MFCD00001630;AKOS009158971;J-009199;FT-0637243;SCHEMBL182434;CYCLOHEXANONE,2-(M-METHOXYPHENYL);2-(3-methoxyphenyl)-cyclohexan-1-one;DB-019418;A1-92399;

标识符

MDL:
MFCD00001630
InChIKey:
KACQSVYTBQDRGP-UHFFFAOYSA-N
Inchi:
1S/C13H16O2/c1-15-11-6-4-5-10(9-11)12-7-2-3-8-13(12)14/h4-6,9,12H,2-3,7-8H2,1H3
SMILES:
O=C1CCCCC1C1C=CC=C(C=1)OC

2-(3-甲氧基苯基)环己酮(15547-89-4)物化性质

实验特性

  • LogP : 2.92190
  • PSA : 26.30000
  • 折射率 : n20/D 1.546(lit.)
  • 沸点 : 140-142°C 0,2mm
  • 闪点 : 华氏:>235.4 °F
    摄氏:>113 °C
  • 颜色与性状 : 未确定
  • 溶解性 : 未确定
  • 密度 : 1.1 g/mL at 25 °C(lit.)

计算特性

  • 精确分子量 : 204.11500
  • 氢键供体数量 : 0
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 2
  • 同位素质量 : 204.11503
  • 重原子数量 : 15
  • 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 : 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) : 2.6
  • 互变异构体数量 : 3
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 26.3

2-(3-甲氧基苯基)环己酮(15547-89-4)安全信息

2-(3-甲氧基苯基)环己酮(15547-89-4)国际标准相关数据

EINECS:
239-602-5

2-(3-甲氧基苯基)环己酮(15547-89-4)海关数据

海关编码:
2914509090
海关数据:

中国海关编码:

2914509090

概述:

2914509090 含其他含氧基的酮. 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, 丙酮报明包装

Summary:

HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

2-(3-甲氧基苯基)环己酮(15547-89-4)推荐厂家 更多厂家(26)

公司名称手机号/电话联系人QQ微信询单
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湖北巨胜科技有限公司 18871490354王珊 1400848866
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2-(3-甲氧基苯基)环己酮(15547-89-4)相关文献

  • 1. Benzyne reaction. Part X. The benzyne reaction of ortho-substituted halogenobenzenes with cyclohexanone in secondary cyclic amines or in organic solvents
    T. Kametani,S. Noguchi,I. Agata,T. Aono,K. Kigasawa,M. Hiiragi,T. Hayasaka,O. Kusama J. Chem. Soc. C 1971 1047

2-(3-甲氧基苯基)环己酮(15547-89-4) MSDS

基础信息

Name:2-(3-Methoxyphenyl)Cyclohexanone Material Safety Data Sheet
Synonym:None
CAS:15547-89-4
Section 1 - Chemical Product ? MSDS Name:2-(3-Methoxyphenyl)Cyclohexanone Material Safety Data Sheet
Synonym:None

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
15547-89-42-(3-Methoxyphenyl)Cyclohexanoneca 100239-602-5
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:
May cause eye irritation. The toxicological properties of this material have not been fully investigated.
Skin:
May cause skin irritation. The toxicological properties of this material have not been fully investigated.
Ingestion:
May cause irritation of the digestive tract. 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.
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:
Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or water.
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. Use water spray to keep fire-exposed containers cool. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Containers may explode when heated.
Extinguishing Media:
Use agent most appropriate to extinguish fire. Cool containers with flooding quantities of water until well after fire is out. 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. Avoid runoff into storm sewers and ditches which lead to waterways. Clean up spills immediately, observing precautions in the Protective Equipment section. Remove all sources of ignition. 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:
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# 15547-89-4: 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: colorless to yellow
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: @ 760.00mm Hg
Freezing/Melting Point: Not available.
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: 1.1000g/cm3
Molecular Formula: C13H16O2
Molecular Weight: 204.27

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, ignition sources, excess heat, 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# 15547-89-4 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-(3-Methoxyphenyl)Cyclohexanone - Not listed by ACGIH, IARC, or NTP.

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# 15547-89-4: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 15547-89-4 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 15547-89-4 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A