(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇

  • 基本信息
  • 物化性质
  • 安全信息
  • 毒理性
  • MSDS
  • 结构与计算化学
  • 上游产品
  • 下游产品

(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 基本信息

中文名称:
(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 
中文别名:
(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 
英文名称:
Methanone,(3-chlorophenyl)(4-methoxy-3-nitrophenyl)-
英文别名:
(3-chlorophenyl)-(4-methoxy-3-nitrophenyl)methanone;
3-chlorophenyl 4-methoxy-3-nitrophenyl ketone;
3-chloro-3'-nitro-4'-methoxybenzophenone;
3-CHLORO-4'-METHOXY-3'-NITROBENZOPHENONE 
CAS No.:
66938-41-8
分 子 式:
C14H10ClNO4
分 子 量:
291.69
精确分子量:
291.03000
PSA:
72.12000
EINECS:
423-290-4
InChI:
The Key: BBKNLCMVMVDRJA-UHFFFAOYSA-N
风险术语:
R68R50/53
安全术语:
S22S60S61S36/S37
分子结构式:
SDS:
查看

(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 物化性质

密度:
1.354g/cm3
熔点:
109-114ºC
沸点:
466.7ºC at 760mmHg
闪点:
236ºC
折射率:
1.604
存储条件/存储方法:

 

 密闭于阴凉干燥环境中
稳定性相关:

 

遵照规定使用和储存则不会分解。

其它信息:

1.      性状:无可用

2.      密度(g/mL,25/4):无可用3.      相对蒸汽密度(g/mL,空气=1):无可用4.      熔点(ºC):109-1145.      沸点(ºC,常压):3106.      沸点(ºC,5.2kPa):无可用7.      折射率:无可用8.      闪点(ºC):无可用9.      比旋光度(º):无可用10.   自燃点或引燃温度(ºC):无可用11.   蒸气压(kPa,25ºC):无可用12.   饱和蒸气压(kPa,60ºC):无可用13.   燃烧热(KJ/mol):无可用14.   临界温度(ºC):无可用15.   临界压力(KPa):无可用16.   油水(辛醇/水)分配系数的对数值:无可用17.   爆炸上限(%,V/V):无可用18.   爆炸下限(%,V/V):无可用19.   溶解性:无可用

(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 安全信息

安全标志:
S22:不要吸入粉尘。
S60:本物质残余物和容器必须作为危险废物处理。
S61:避免排放到环境中。参考专门的说明/安全数据表。
:
危险标志:
N-Xn,N,Xn

(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 毒理性

生态数据:

 

该物质对环境可能有危害,对水体应给予特别注意。

(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 MSDS

Name: (3-Chlorophenyl)(4-methoxy-3-nitrophenyl)methanone 97% Material Safety Data Sheet
Synonym: 3-Chloro-4'-methoxy-3'-nitrobenzophenone
CAS: 66938-41-8
Section 1 - Chemical Product   MSDS Name:(3-Chlorophenyl)(4-methoxy-3-nitrophenyl)methanone 97% Material Safety Data Sheet
Synonym:3-Chloro-4'-methoxy-3'-nitrobenzophenone

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
66938-41-8 (3-Chlorophenyl)(4-methoxy-3-nitrophen 97 423-290-4
Hazard Symbols: XN N
Risk Phrases: 50/53 68

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.Possible risk of irreversible effects.The toxicological properties of this material have not been fully investigated.Dangerous for the environment.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. No skin absorption data found.
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. Runoff from fire control or dilution water may cause pollution.
Extinguishing Media:
Use agent most appropriate to extinguish fire. 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:
Vacuum or sweep up material and place into a suitable disposal container. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions.
Provide ventilation.

Section 7 - HANDLING and STORAGE
  Handling:
Wash thoroughly after handling. Use with adequate ventilation.
Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Do not breathe dust.
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:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 66938-41-8: 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: Powder
Color: light yellow
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 310 deg C
Freezing/Melting Point: 109-114 deg C
Autoignition Temperature: Not applicable.
Flash Point: 270 deg C ( 518.00 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: 270 deg C
Solubility in water: 13 g/100 ml aceton
Specific Gravity/Density:
Molecular Formula: C14H10ClNO4
Molecular Weight: 291.69

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Dust generation, excess heat, temperatures above 250C.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, oxides of nitrogen, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 66938-41-8 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
(3-Chlorophenyl)(4-methoxy-3-nitrophenyl)methanone - 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: Not regulated.
Hazard Class:
UN Number:
Packing Group:
IMO
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing Group:
RID/ADR
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing group:

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XN N
Risk Phrases:
R 50/53 Very toxic to aquatic organisms, may cause
long-term adverse effects in the aquatic environment.
R 68 Possible risk of irreversible effects.
Safety Phrases:
S 22 Do not breathe dust.
S 36/37 Wear suitable protective clothing and
gloves.
S 60 This material and its container must be
disposed of as hazardous waste.
S 61 Avoid release to the environment. Refer to
special instructions/safety data sheets.
WGK (Water Danger/Protection)
CAS# 66938-41-8: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 66938-41-8 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 66938-41-8 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 分子结构与计算化学数据

分子结构数据

1、  摩尔折射率:74.16

2、  摩尔体积(m3/mol):215.3

3、  等张比容(90.2K):574.9

4、  表面张力(dyne/cm):50.8

5、  极化率10-24cm3):29.40

计算化学数据

1.疏水参数计算参考值(XlogP):3.7

2.氢键供体数量:0

3.氢键受体数量:4

4.可旋转化学键数量:3

5.互变异构体数量:无

6.拓扑分子极性表面积72.1

7.重原子数量:20

8.表面电荷:0

9.复杂度:371

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

(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 上游产品

(3-氯苯基)(4-甲氧基-3-硝基苯基)甲基环己醇 下游产品

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产品介绍:
产品名称:(3-氯苯基)(4-甲氧基-3-硝基苯基)甲酮 Cas号:66938-41-8 纯度:97% 包装信息:100mg 价格:659.0元
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