2164-61-6 (3-羧基哒嗪,Pyridazine-3-carboxylic acid)

CAS号:
2164-61-6
中文名称:
3-羧基哒嗪
英文名称:
Pyridazine-3-carboxylic acid
安全信息:
分子式:
C5H4N2O2
分子量:
124.097460746765

3-羧基哒嗪(2164-61-6)名称与标识符

名称

中文别名:
3-羧基哒嗪;哒嗪-3-羧酸;哒嗪-3-甲酸;3-哒嗪羧酸;3-羧酸哒嗪;
英文别名:
Pyridazine-3-carboxylic acid;3-Pyridazine carboxylic acid;3-Pyridazinecarboxyl;3-Carboxypyridazine;3-Pyridazinecarboxylic acid;PubChem22109;pyridazine carboxylic acid;KSC202Q0P;RUUOPSRRIKJHNH-UHFFFAOYSA-N;BCP26827;STK891483;SBB053230;NSC110335;RW2865;RP00723;VP300;3-PIPERIDINOBENZOICACID;Z1201621268;CHEMBL395179;PB21767;U-27136;AKOS000279282;CS-W004823;W-206659;AC-29678;MFCD01646333;A815575;2164-61-6;PYRIDAZINE-3-CARBOXYLICACID;SY013220;NCGC00337040-01;76DXK4XC7R;SCHEMBL28293;AB01330397-02;AMY24938;NSC-110335;PS-3253;217447-50-2;U 27136;3-Pyridazinecarboxylicacid;BB 0216421;DTXSID80296601;Pyridazine-3-carboxylic acid, 97%;EN300-79022;FT-0616371;3-Carboxypyridazine;Pyridazine-3-carboxylic acid;AC-907/34123062;ALBB-012268;DB-028574;688-382-0;

标识符

MDL:
MFCD01646333
InChIKey:
RUUOPSRRIKJHNH-UHFFFAOYSA-N
Inchi:
1S/C5H4N2O2/c8-5(9)4-2-1-3-6-7-4/h1-3H,(H,8,9)
SMILES:
OC(C1=CC=CN=N1)=O

3-羧基哒嗪(2164-61-6)物化性质

实验特性

  • LogP : 0.17480
  • PSA : 63.08000
  • 折射率 : 1.578
  • 沸点 : 404.2±18.0°C at 760 mmHg
  • 熔点 : 200-209 °C
  • 闪点 : 198.3 °C
  • 敏感性 : Moisture Sensitive
  • 密度 : 1.403

计算特性

  • 精确分子量 : 124.02700
  • 氢键供体数量 : 1
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 1
  • 同位素质量 : 124.027
  • 重原子数量 : 9
  • 复杂度 : 116
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : -0.1
  • 拓扑分子极性表面积 : 63.1

3-羧基哒嗪(2164-61-6)海关数据

海关编码:
2933990090
海关数据:

中国海关编码:

2933990090

概述:

2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素:

品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期

Summary:

2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

3-羧基哒嗪(2164-61-6)相关文献

3-羧基哒嗪(2164-61-6) MSDS

基础信息

Name:3-Pyridazinecarboxylic acid 97% Material Safety Data Sheet
Synonym:
CAS:2164-61-6
Section 1 - Chemical Product ? MSDS Name:3-Pyridazinecarboxylic acid 97% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
2164-61-63-Pyridazinecarboxylic acid97%unlisted
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes 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. 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# 2164-61-6: 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: Not available.
Freezing/Melting Point: 103.8 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: C5H4N2O2
Molecular Weight: 124.1

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# 2164-61-6 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
3-Pyridazinecarboxylic acid - 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: XI
Risk Phrases:
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# 2164-61-6: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 2164-61-6 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 2164-61-6 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A