2-硝基-3-氯甲苯

2-硝基-3-氯甲苯 基本信息
CAS号 5367-26-0 分子式 C7H6ClNO2
分子量 171.58100 精确质量  171.00900
PSA  45.82000 LogP  3.07980

基本信息 展开↓

CAS号:
5367-26-0
3D弹球模型:
立即前往扯扯看
分子式:
C7H6ClNO2
分子量:
171.58100
中文名称:
2-硝基-3-氯甲苯
英文名称:
3-Chloro-2-nitrotoluene
中文别名:
2-硝基-3-氯甲苯;
3-氯-2-硝基甲苯
英文别名:
3-Chloro-2-nitrotoluene;
2-Nitro-3-Chlorotoluene;
1-chloro-3-methyl-2-nitrobenzene
精确分子量/精确质量:
171.00900
极性分子表面积/PSA:
45.82000
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:
226-354-8
InChI:
InChI=1/C15H22N2O4/c18-17(19)14-4-6-15(7-5-14)21-11-3-1-2-8-16-9-12-20-13-10-16/h4-7H,1-3,8-13H2

物化性质展开↓

密度:
1.324g/cm3
沸点:
251.9ºC at 760mmHg
闪点:
106.2ºC
折射率:
1.534

安全信息展开↓

海关代码:
2904909090

合成路线查看所有的合成路线

  • 7664-93-9

    硫酸

  • +

  • 219312-08-0

    4-chloro-2-methyl-3-nitro-aniline

  • 5367-26-0

    2-硝基-3-氯甲苯

  • 39053-44-6

    2-chloro-4-methyl-3-nitro-aniline

  • 5367-26-0

    2-硝基-3-氯甲苯

  • 108-41-8

    3-氯甲苯

  • +

  • 7697-37-2

    硝酸

  • 5367-26-0

    2-硝基-3-氯甲苯

  • +

  • 5367-28-2

    5-氯-2-硝基甲苯

MSDS 展开↓

Name: 3-Chloro-2-nitrotoluene Material Safety Data Sheet
Synonym:
CAS: 5367-26-0
Section 1 - Chemical Product   MSDS Name:3-Chloro-2-nitrotoluene Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
5367-26-0 3-Chloro-2-nitrotoluene 226-354-8
Hazard Symbols: XN
Risk Phrases: 20/21/22 36/37/38

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed.
Irritating to eyes, respiratory system and skin.Hygroscopic (absorbs moisture from the air).
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. Harmful if absorbed through the skin.
Ingestion:
Harmful if swallowed. May cause irritation of the digestive tract.
Inhalation:
Harmful if inhaled. Causes 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:
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:
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# 5367-26-0: 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: Solid
Color: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 57 deg C @ 0.4 mmHg
Freezing/Melting Point: 22 - 23 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:
Specific Gravity/Density:
Molecular Formula: C7H6ClNO2
Molecular Weight: 171.5005

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

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 5367-26-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
3-Chloro-2-nitrotoluene - 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
No information available.
IMO
No information available.
RID/ADR
No information available.

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.
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 5367-26-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 5367-26-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 5367-26-0 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:2904909090

概述:
2904909090 其他烃的磺化、硝化、亚硝化衍生物(不论是否卤化). 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
摘要/Summary:
HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

分子结构与计算化学数据展开↓

计算化学数据


1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:0

3.氢键受体数量:2

4.可旋转化学键数量:0

5.互变异构体数量:无

6.拓扑分子极性表面积:45.8

7.重原子数量:11

8.表面电荷:0

9.复杂度:157

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

上下游相关产品

上游产品

更多
  • 2719-14-4

    N-(4-甲基-3-硝基苯基)乙酰胺

  • 108-41-8

    3-氯甲苯

  • 87-63-8

    2-氯-6-甲基苯胺

  • 70343-09-8

    2,3-dinitro-4-methylaniline

  • 219312-08-0

    4-chloro-2-methyl-3-nitro-aniline

下游产品

更多
  • 4771-47-5

    3-氯-2-硝基苯甲酸

  • 53924-05-3

    7-氯吲哚

  • 601-87-6

    3-甲基-2-硝基苯胺

  • 56433-00-2

    1-(溴甲基)-3-氯-2-硝基苯

立即下载安装“化学加”APP
专业、功能强大,随时调用更加方便