3-苯胺基-2-环己烯-1-酮

  • 基本信息
  • 物化性质
  • 安全信息
  • 毒理性
  • MSDS
  • 海关数据
  • 结构与计算化学
  • 上游产品
  • 下游产品
  • 表征图谱

3-苯胺基-2-环己烯-1-酮 基本信息

中文名称:
3-苯胺基-2-环己烯-1-酮 
中文别名:
3-苯胺基-2-环己烯-1-酮;
3-苯胺基环己基-2-烯-1-酮 
英文名称:
2-Cyclohexen-1-one,3-(phenylamino)-
英文别名:
3-ANILINOCYCLOHEX-2-EN-1-ONE;
3-(Phenylamino)cyclohex-2-enone;
3-Anilino-2-cyclohexen-1-one;
N-phenyl-3-aminocyclohex-2-enone;
3-anilinocyclohex-2-ene-1-one;
3-phenylamino-cyclohex-2-enone 
CAS No.:
24706-50-1
分 子 式:

C12H13NO

分 子 量:
187.26
精确分子量:
187.10000
PSA:
29.10000
MDL:
MFCD00082654
BRN:
2103381
InChI:
The Key: IVONJXTZXFTWNA-UHFFFAOYSA-N
危险品标志:

 

风险术语:

R36/37/38

安全术语:

S24/25

分子结构式:
SDS:
查看

3-苯胺基-2-环己烯-1-酮 物化性质

密度:
1.176g/cm3
熔点:
178-182 °C
沸点:
324.9ºC at 760mmHg
闪点:
135.6ºC
折射率:
1.629
蒸汽压:
0.000238mmHg at 25°C
存储条件/存储方法:

保持贮藏器密封

放入紧密的贮藏器内,储存在阴凉,干燥的地方

稳定性相关:

如果遵照规格使用和储存则不会分解

避免接触氧化物

其它信息:

1.       性状:未确定

2.       密度(g/mL,25/4℃):未确定

3.       相对蒸汽密度(g/mL,空气=1):未确定

4.       熔点(ºC):176-178

5.       沸点(ºC,常压):未确定

6.       沸点(ºC,5.2kPa):未确定

7.       折射率:未确定

8.       闪点(ºC):未确定

9.       比旋光度(º):未确定

10.    自燃点或引燃温度(ºC):未确定

11.    蒸气压(kpa,20ºC):未确定

12.    饱和蒸气压(kPa,60ºC):未确定

13.    燃烧热(KJ/mol):未确定

14.    临界温度(ºC):未确定

15.    临界压力(KPa):未确定

16.    油水(辛醇/水)分配系数的对数值:未确定

17.    爆炸上限(%,V/V):未确定

18.    爆炸下限(%,V/V):未确定

19.    溶解性:未确定

3-苯胺基-2-环己烯-1-酮 安全信息

海关代码:
2922399090
危险类别码:
R36/37/38
安全说明:
S24/25
RTECS号:
GW7600000
安全标志:
S24/25:防止皮肤和眼睛接触。
危险标志:
Xi: Irritant;

3-苯胺基-2-环己烯-1-酮 毒理性

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GW7600000
CHEMICAL NAME :
2-Cyclohexen-1-one, 3-(phenylamino)-
CAS REGISTRY NUMBER :
24706-50-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H13-N-O
MOLECULAR WEIGHT :
187.26

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
600 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JKXXAF Japanese Kokai Tokyo Koho Patents. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #92-282314
毒理学数据:

急性毒性:小鼠腹腔LD50600mg/kg

生态数据:

通常来说对水是不危害的,若无政府许可,勿将材料排入周围环境

3-苯胺基-2-环己烯-1-酮 MSDS

Name: 3-(Phenylamino)cyclohex-2-ene-1-one 98% Material Safety Data Sheet
Synonym:
CAS: 24706-50-1
Section 1 - Chemical Product   MSDS Name:3-(Phenylamino)cyclohex-2-ene-1-one 98% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
24706-50-1 3-(Phenylamino)cyclohex-2-ene-1-one 98% unlisted
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Not available.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
May cause respiratory tract irritation. May be harmful if inhaled.
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.
Notes to Physician:
Treat symptomatically and supportively.

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:
Vacuum or sweep up material and place into a suitable disposal 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# 24706-50-1: 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: Crystalline powder
Color: yellow-green - fine
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 178 - 182 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: Insoluble.
Specific Gravity/Density:
Molecular Formula: C12H13NO
Molecular Weight: 187.24

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

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 24706-50-1: GW7600000 LD50/LC50:
Not available.
Carcinogenicity:
3-(Phenylamino)cyclohex-2-ene-1-one - 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.
WGK (Water Danger/Protection)
CAS# 24706-50-1: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 24706-50-1 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 24706-50-1 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

3-苯胺基-2-环己烯-1-酮 海关数据

中国海关编码:2922399090

概述:
2922399090 其他氨基醛、氨基酮及其盐(包括氨基醌及其盐,但含有一种以上含氧基的除外). 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%
申报要素:
品名, 成分含量, 用途, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
摘要/Summary:
2922399090 other amino-aldehydes, amino-ketones and amino-quinones, other than those containing more than one kind of oxygen function; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

3-苯胺基-2-环己烯-1-酮 分子结构与计算化学数据

分子结构数据

1   摩尔折射率:56.62

2   摩尔体积m3/mol159.1

3   等张比容(90.2K):431.8

4   表面张力dyne/cm54.1

5   极化率10-24cm322.44

计算化学数据

1.疏水参数计算参考值(XlogP):2.2

2.氢键供体数量:1

3.氢键受体数量:2

4.可旋转化学键数量:2

5.互变异构体数量:8

6.拓扑分子极性表面积29.1

7.重原子数量:14

8.表面电荷:0

9.复杂度:239

10.同位素原子数量:0

11.确定原子立构中心数量:0

12.不确定原子立构中心数量:0

13.确定化学键立构中心数量:0

14.不确定化学键立构中心数量:0

15.共价键单元数量:1

推荐供应商更多供应商>>

北京百灵威科技有限公司

产品介绍:
产品名称:3-苯胺基-2-环己烯-1-酮 569356 Cas号:24706-50-1 纯度:98% 包装信息:5g,25g 价格:洽谈
联系方式:
联系人:翟先生 电话:18210857532 手机:18210857532