2-氯-3,5-二硝基吡啶

  • 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
  • 表征图谱

2-氯-3,5-二硝基吡啶 基本信息

中文名称:
2-氯-3,5-二硝基吡啶 
中文别名:
2-氯-3,5-二硝基吡啶;
(2R)-2-ammonio-5-(benzyloxy)-5-oxopentanoate;
D-Glutamic acid γ-benzyl ester;
H-D-Glu(OBzl)-OH;
(2S,3R)-1-methoxy-3-methyl-1-oxopentan-2-aminium;
(2R,3R)-1-methoxy-3-methyl-1-oxopentan-2-aminium;
isoleucine, methyl ester;
methyl isoleucinate;
Diflorasone;
M-Carbomethoxybenzotrifluoride;
Methyl3-(trifluoromethyl)benzoate;
2,2,2-trifluoro-1-(1H-pyrrol-2-yl)ethanone;
Methyl 3-Trifluoromethylbenzoate;
Methyl 3-(trifluoromethyl)benzoate 
英文名称:
Pyridine,2-chloro-3,5-dinitro-
英文别名:
2-chloro-3,5-dinitropyridine;
EINECS 219-937-3;
3,5-dinitro-2-chloropyridine;
2-Chlor-3,5-dinitro-pyridin;
2-Chloro-3,5-dinitropyridine;
Pyridine,2-chloro-3,5-dinitro;
2-Chloro3,5-dinitropyridine 
CAS No.:
2578-45-2
分 子 式:
C5H2ClN3O4
分 子 量:
203.54
精确分子量:
202.97300
PSA:
104.53000
MDL:
MFCD00006233
EINECS:
219-937-3
BRN:
196026
InChI:
InChI=1/C5H2ClN3O4/c6-5-4(9(12)13)1-3(2-7-5)8(10)11/h1-2H
风险术语:
R25
安全术语:
S26S45S36/S37/S39
分子结构式:
SDS:
查看

2-氯-3,5-二硝基吡啶 物化性质

外观与性状:
淡黄色结晶粉末
密度:
1.72g/cm3
熔点:
63-65 °C(lit.)
沸点:
320.9ºC at 760 mmHg
闪点:
147.9ºC
折射率:
1.634
蒸汽压:
0.000577mmHg at 25°C
存储条件/存储方法:

密封于2-8ºC阴凉干燥环境。

稳定性相关:

如果遵照规格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):63-65

5.       沸点(ºC,常压):无可用

6.       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

2-氯-3,5-二硝基吡啶 安全信息

包装等级:
II
风险类别:
6.1
WGK_Germany:
3
德国有关水污染物质的分类清单
危险类别码:
R25
安全说明:
S26-S36/37/39-S45
RTECS号:
US6504750
安全标志:
S26:万一接触眼睛,立即使用大量清水冲洗并送医诊治。
S45:出现意外或者感到不适,立刻到医生那里寻求帮助(最好带去产品容器标签)。
:
危险标志:
T: Toxic;Xi: Irritant;

2-氯-3,5-二硝基吡啶 毒理性

毒理学数据:

1
试验方法:口服
摄入剂量: 50毫克/公斤
测试对象:啮齿动物-
毒性类型:急性
毒性作用: 1.肌肉无力
2.
胸部或呼吸-紫绀

2

试验方法:腹腔
摄入剂量: 10毫克/千克
测试对象:啮齿动物-
毒性类型:急性
毒性作用: 1.嗜睡(普通抑郁活动)
2.
惊厥或癫痫阈值的影响
3.
肌肉无力

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。

2-氯-3,5-二硝基吡啶 MSDS

Name: 2-Chloro-3 5-Dinitropyridine 99% Material Safety Data Sheet
Synonym: None Known
CAS: 2578-45-2
Section 1 - Chemical Product   MSDS Name:2-Chloro-3 5-Dinitropyridine 99% Material Safety Data Sheet
Synonym:None Known

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
2578-45-2 2-Chloro-3,5-Dinitropyridine 99% 219-937-3
Hazard Symbols: XI
Risk Phrases: 36/38

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Irritating to eyes and skin.
Potential Health Effects
Eye:
Causes eye irritation. May cause chemical conjunctivitis.
Skin:
Causes skin irritation.
Ingestion:
May cause gastrointestinal irritation with nausea, vomiting and diarrhea. May cause cardiac disturbances. May cause central nervous system depression. May be harmful if swallowed.
Inhalation:
May cause respiratory tract irritation. May cause cardiac abnormalities. Can produce delayed pulmonary edema. Inhalation at high concentrations may cause CNS depression and asphixiation.
Chronic:
Effects may be delayed.

Section 4 - FIRST AID MEASURES
  Eyes: Immediately 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 breathing is difficult, give oxygen. Get medical aid. Do NOT use mouth-to-mouth resuscitation. If breathing has ceased apply artificial respiration using oxygen and a suitable mechanical device such as a bag and a mask.
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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Containers may explode when heated. Non-combustible, substance itself does not burn but may decompose upon heating to produce irritating, corrosive and/or toxic fumes. Runoff from fire control or dilution water may cause pollution.
Extinguishing Media:
Use water spray to cool fire-exposed containers. For small fires, use dry chemical, carbon dioxide, or water spray. For large fires, use dry chemical, carbon dioxide, alcohol-resistant foam, or water spray.

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:
Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Use with adequate ventilation. Wash clothing before reuse.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep refrigerated. (Store below 4C/39F.)

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# 2578-45-2: 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: Solid
Color: slightly yellow
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 64.00 - 66.00 deg C
Autoignition Temperature: Not applicable.
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C5H2ClN3O4
Molecular Weight: 203.54

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Incompatible materials, dust generation, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, nitrogen oxides, carbon monoxide, carbon dioxide, nitrogen.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 2578-45-2: US6504750 LD50/LC50:
CAS# 2578-45-2: Dermal, guinea pig: LD50 = >1 gm/kg; Oral, mouse: LD50 = 50 mg/kg; Oral, rat: LD50 = 50 mg/kg.
Carcinogenicity:
2-Chloro-3,5-Dinitropyridine - 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
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.*
Hazard Class: 6.1
UN Number: 2811
Packing Group: III
IMO
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2811
Packing Group: III
RID/ADR
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2811
Packing group: III

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/38 Irritating to eyes and skin.
Safety Phrases:
S 28A After contact with skin, wash immediately with
plenty of water.
WGK (Water Danger/Protection)
CAS# 2578-45-2: No information available.
Canada
CAS# 2578-45-2 is listed on Canada's NDSL List.
CAS# 2578-45-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 2578-45-2 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

2-氯-3,5-二硝基吡啶 分子结构与计算化学数据

分子结构数据

1摩尔折射率:无可用

2、   摩尔体积(cm3/mol): 无可用

3、   等张比容(90.2K):无可用

4、   表面张力(dyne/cm):无可用

5、   极化率:无可用

计算化学数据

1.疏水参数计算参考值(XlogP):1.5

2.氢键供体数量:0

3.氢键受体数量:5

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105

7.重原子数量:13

8.表面电荷:0

9.复杂度:225

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

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