1-苯基-2,4-戊二酮

1-苯基-2,4-戊二酮 基本信息
CAS号 3318-61-4 分子式 C11H12O2
分子量 176.21200 精确质量  176.08400
PSA  34.14000 LogP  1.77730

基本信息 展开↓

CAS号:
3318-61-4
3D弹球模型:
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分子式:
C11H12O2
分子量:
176.21200
中文名称:
1-苯基-2,4-戊二酮
英文名称:
1-phenylpentane-2,4-dione
中文别名:
1-苯基-2,4-戊二酮;
1-苯基-2,4-戊烷二酮
英文别名:
1-phenylpentane-2,4-dione;
1-Phenyl-2,4-pentandion;
2,4-Pentanedione,1-phenyl;
1-Phenyl-pentan-2,4-dion;
1-phenyl-pentane-2,4-dione;
1-PHENYL-2,4-PENTANEDIONE;
1-phenyl-2,4-pentadione;
3-phenylacetylacetone
精确分子量/精确质量:
176.08400
极性分子表面积/PSA:
34.14000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
EINECS:
222-015-3
InChI:
The Key: NROOHYGFTHTDFF-UHFFFAOYSA-N

物化性质展开↓

密度:
1.061g/cm3
沸点:
277.7ºC at 760mmHg
闪点:
103.2ºC
折射率:
1.511

安全信息展开↓

海关代码:
2914399090

合成路线查看所有的合成路线

  • 10521-97-8

    5-phenylpent-3-en-2-one

  • ~62%

  • 3318-61-4

    1-苯基-2,4-戊二酮

  • 101-97-3

    苯乙酸乙酯

  • +

  • 67-64-1

    丙酮

  • ~44%

  • 3318-61-4

    1-苯基-2,4-戊二酮

  • 1007-32-5

    1-苯基-2-丁酮

  • +

  • 141-78-6

    乙酸乙酯

  • 3318-61-4

    1-苯基-2,4-戊二酮

  • +

  • 109839-21-6

    3-phenylhexane-2,4-dione

MSDS 展开↓

Name: 1-Phenyl-2 4-pentanedione 96% (gc) Material Safety Data Sheet
Synonym:
CAS: 3318-61-4
Section 1 - Chemical Product   MSDS Name:1-Phenyl-2 4-pentanedione 96% (gc) Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
3318-61-4 2,4-pentanedione, 1-phenyl- 96.0 222-015-3
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Not available.
Potential Health Effects
The toxicological properties of this material have not been investigated. Use appropriate procedures to prevent opportunities for direct contact with the skin or eyes and to prevent inhalation.

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. Remove contaminated clothing and shoes.
Ingestion:
If victim is conscious and alert, give 2-4 cupfuls of milk or water.
Get medical aid immediately.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen.
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 agent most appropriate to extinguish fire.

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.

Section 7 - HANDLING and STORAGE
  Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Avoid contact with eyes, skin, and clothing. Avoid ingestion and inhalation.
Storage:
Store in a cool, dry place. Keep container closed when not in use.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
  Engineering Controls:
Use process enclosure, local exhaust ventilation, or other engineering controls to control airborne levels.
Exposure Limits CAS# 3318-61-4: Personal Protective Equipment Eyes: Wear chemical splash goggles.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to minimize contact with skin.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
 
Physical State: Not available
Color: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 144 deg C @ 15.00mm Hg
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: > 110 deg C (> 230.00 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: 1.0540g/cm3
Molecular Formula: C11H12O2
Molecular Weight: 176.22

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, strong oxidants.
Incompatibilities with Other Materials:
Not available.
Hazardous Decomposition Products:
Irritating and toxic fumes and gases.
Hazardous Polymerization: Not available.

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 3318-61-4 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2,4-pentanedione, 1-phenyl- - 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.
WGK (Water Danger/Protection)
CAS# 3318-61-4: No information available.
Canada
CAS# 3318-61-4 is listed on Canada's NDSL List.
CAS# 3318-61-4 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 3318-61-4 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

海关数据查看详细

中国海关编码:2914399090

概述:
2914399090. 其他不含其他含氧基的芳香酮. 增值税率:17.0%. 退税率:13.0%. 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
摘要/Summary:
2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

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