3-丁氧基-2-环己烯-1-酮

3-丁氧基-2-环己烯-1-酮 基本信息
CAS号 16493-04-2 分子式 C10H16O2
分子量 168.23300 精确质量  168.11500
PSA  26.30000 LogP  2.44000

基本信息 展开↓

CAS号:
16493-04-2
3D弹球模型:
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分子式:
C10H16O2
分子量:
168.23300
中文名称:
3-丁氧基-2-环己烯-1-酮
英文名称:
3-BUTOXYCYCLOHEX-2-EN-1-ONE
中文别名:
3-丁氧基-2-环己烯-1-酮
英文别名:
3-BUTOXYCYCLOHEX-2-EN-1-ONE;
3-n-butoxy-2-cyclohexen-1-one;
3-butoxy-2-cyclohexenone;
2-Cyclohexen-1-one,3-butoxy;
1-Butoxy-3-oxocyclohex-2-ene;
3-Butoxy-cyclohex-2-enon;
3-butanoxycyclohex-2-en-1-one;
3-butoxy-cyclohex-2-enone
精确分子量/精确质量:
168.11500
极性分子表面积/PSA:
26.30000
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。
InChI:
The Key: HQFGJBVERCJECK-UHFFFAOYSA-N

物化性质展开↓

密度:
0.97 g/cm3
沸点:
280.6ºC at 760 mmHg
闪点:
121.1ºC
折射率:
1.468
蒸汽压:
0.00375mmHg at 25°C

安全信息展开↓

海关代码:
2914509090
危险类别码:
R20/21/22
安全说明:
S36/37
危险标志:
Xi: Irritant;

合成路线查看所有的合成路线

  • 504-02-9

    1,3-环己二酮

  • +

  • 71-36-3

    正丁醇

  • ~94%

  • 16493-04-2

    3-丁氧基-2-环己烯-1-酮

  • 118824-38-7

    3-(4-phenylselenobutanoxy)cyclohex-2-en-1-one

  • ~73%

  • 92015-83-3

    92015-83-3

  • +

  • 16493-04-2

    3-丁氧基-2-环己烯-1-酮

  • 53293-00-8

    5-己炔酸

  • +

  • 71-36-3

    正丁醇

  • ~71%

  • 16493-04-2

    3-丁氧基-2-环己烯-1-酮

MSDS 展开↓

Name: 3-Butoxycyclohex-2-en-1-one 97% Material Safety Data Sheet
Synonym:
CAS: 16493-04-2
Section 1 - Chemical Product   MSDS Name:3-Butoxycyclohex-2-en-1-one 97% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
16493-04-2 3-Butoxycyclohex-2-en-1-one 97% 240-557-9
Hazard Symbols: XN
Risk Phrases: 20/21/22

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. Harmful if absorbed through the skin.
Ingestion:
Harmful if swallowed. May cause irritation of the digestive tract.
Inhalation:
Harmful if inhaled. May cause respiratory tract irritation.
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. 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.
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# 16493-04-2: 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: Liquid
Color: yellow
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C10H16O2
Molecular Weight: 168

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents, reducing agents.
Hazardous Decomposition Products:
Carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 16493-04-2 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
3-Butoxycyclohex-2-en-1-one - 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
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.*
Hazard Class: 6.1
UN Number: 2810
Packing Group: III
IMO
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2810
Packing Group: III
RID/ADR
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2810
Packing group: III

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XN
Risk Phrases:
R 20/21/22 Harmful by inhalation, in contact with
skin and if swallowed.
Safety Phrases:
S 36/37 Wear suitable protective clothing and
gloves.
WGK (Water Danger/Protection)
CAS# 16493-04-2: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 16493-04-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 16493-04-2 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

海关数据查看详细

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
摘要/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%

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