1196-43-6 (黄嘌呤钠盐,Xanthine sodium salt)

CAS号:
1196-43-6
中文名称:
黄嘌呤钠盐
英文名称:
Xanthine sodium salt
安全信息:
分子式:
C5H3N4NaO2
分子量:
174.092690706253

黄嘌呤钠盐(1196-43-6)名称与标识符

名称

中文别名:
黄嘌呤钠盐;2,6-二羟基嘌呤钠盐;2,6-二羟基嘌呤;黄嘌呤;
英文别名:
Xanthine sodium salt;2,6-Dihydroxypurine sodium salt;1H-Purine-2,6-dione,3,7-dihydro-,monosodium salt;2,6-Dihydroxypurine;crystalline98-1;XANTHINE MONOSODIUM SALT;Xanthine SodiuM Anhydrous;XANTHINE SODIUM CELL CULTURE TESTED;XANTHINE SODIUM SALT CRYSTALLINE 98-1;sodium;3H-purin-7-ide-2,6-dione;Xanthine, monosodium salt;1196-43-6;J-004168;sodium 2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-ide;Xanthine monosodium salt, monohydrate;

标识符

MDL:
MFCD00069699
InChIKey:
HKDXLLDCXWUUKY-UHFFFAOYSA-M
Inchi:
1S/C5H4N4O2.Na/c10-4-2-3(7-1-6-2)8-5(11)9-4;/h1H,(H3,6,7,8,9,10,11);/q;+1/p-1
SMILES:
[Na+].O=C1C2=C(N=C[N-]2)NC(N1)=O

黄嘌呤钠盐(1196-43-6)物化性质

实验特性

  • LogP : -0.21000
  • PSA : 97.49000
  • 沸点 : Not available
  • 熔点 : Not available
  • 蒸气压 : Not available
  • 闪点 : Not available
  • 溶解度 : dilute NaOH: clear to hazy
  • 密度 : Not available

计算特性

  • 精确分子量 : 174.01500
  • 氢键供体数量 : 2
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 0
  • 同位素质量 : 174.015
  • 重原子数量 : 12
  • 复杂度 : 232
  • 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 : 2
  • 拓扑分子极性表面积 : 93.2A^2

黄嘌呤钠盐(1196-43-6)国际标准相关数据

EINECS:
272-117-7

黄嘌呤钠盐(1196-43-6)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%

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黄嘌呤钠盐(1196-43-6)相关文献

黄嘌呤钠盐(1196-43-6)参考资料

Reaxys RN:
PubChem CID:

黄嘌呤钠盐(1196-43-6) MSDS

基础信息


Section 1. Chemical Product and Company Identification
    Xanthine monosodium salt monohydrate        Catalog    
    XA113
    Common Name/
    Number(s).
    Trade Name
    CAS#        1196-43-6    
    Manufacturer
    RTECS        Not available.    
    SPECTRUM CHEMICAL MFG. CORP.
    TSCA        TSCA 8(b) inventory:    
    Xanthine monosodium salt
    monohydrate
    Commercial Name(s)        Not available.    
    CI#        Not available.    
    Synonym        3,7-Dihydro-1H-purine-2,6-dione monosodiumsalt    
    IN CASE OF EMERGENCY
    Not available.
    Chemical Name
    Chemical Family        Not available.        CALL (310) 516-8000    
    C5H3N4O2Na.H2O
    Chemical Formula
    SPECTRUM CHEMICAL MFG. CORP.

Section 2.Composition and Information on Ingredients
    Exposure Limits
    TWA (mg/m3)        STEL (mg/m3) CEIL (mg/m3)    
    Name        CAS #        % by Weight    
    1) Xanthine monosodium salt monohydrate        1196-43-6        100    
    Toxicological Data        Xanthine monosodium salt monohydrate    
    on Ingredients        LD50: Not available.    
    LC50: Not available.

Section 3. Hazards Identification
    Potential Acute Health Effects Very hazardous in case of ingestion. Hazardous in case of skin contact (irritant), of eye contact (irritant). Slightly
    hazardous in case of inhalation.
    Potential Chronic Health        Very hazardous in case of ingestion.    
    Effects        Hazardous in case of skin contact (irritant), of eye contact (irritant).    
    Slightly hazardous in case of inhalation.
    CARCINOGENIC EFFECTS: Not available.
    MUTAGENIC EFFECTS: Not available.
    TERATOGENIC EFFECTS: Not available.
    DEVELOPMENTAL TOXICITY: Not available.
    The substance is toxic to blood, kidneys, the nervous system.
    Repeated or prolonged exposure to the substance can produce target organs damage.
    Xanthine monosodium salt monohydrate

Section 4. First Aid Measures
    Eye Contact        Check for and remove any contact lenses. Do not use an eye ointment. Seek medical attention.    
    Skin Contact        After contact with skin, wash immediately with plenty of water. Gently and thoroughly wash the contaminated skin    
    with running water and non-abrasive soap. Be particularly careful to clean folds, crevices, creases and groin.
    Cover the irritated skin with an emollient. If irritation persists, seek medical attention. Wash contaminated
    clothing before reusing.
    Serious Skin Contact        Wash with a disinfectant soap and cover the contaminated skin with an anti-bacterial cream. Seek medical    
    attention.
    Inhalation        Allow the victim to rest in a well ventilated area. Seek immediate medical attention.    
    Serious Inhalation        Not available.    
    Ingestion        Do not induce vomiting. Loosen tight clothing such as a collar, tie, belt or waistband. If the victim is not    
    breathing, perform mouth-to-mouth resuscitation. Seek immediate medical attention.
    Serious Ingestion        Not available.    

Section 5. Fire and Explosion Data
    Flammability of the Product May be combustible at high temperature.
    Auto-Ignition Temperature Not available.
    Flash Points        Not available.    
    Flammable Limits        Not available.    
    These products are carbon oxides (CO, CO2), nitrogen oxides (NO, NO2...). Some metallic oxides.
    Products of Combustion
    Fire Hazards in Presence of Not available.
    Various Substances
    Explosion Hazards in Presence Risks of explosion of the product in presence of mechanical impact: Not available.
    of Various Substances        Risks of explosion of the product in presence of static discharge: Not available.    
    Fire Fighting Media        SMALL FIRE: Use DRY chemical powder.    
    and Instructions        LARGE FIRE: Use water spray, fog or foam. Do not use water jet.    
    Special Remarks on        Not available.    
    Fire Hazards
    Special Remarks on Explosion Not available.
    Hazards

Section 6. Accidental Release Measures
    Small Spill        Use appropriate tools to put the spilled solid in a convenient waste disposal container. Finish cleaning by    
    spreading water on the contaminated surface and dispose of according to local and regional authority
    requirements.
    Large Spill
    Use a shovel to put the material into a convenient waste disposal container. Finish cleaning by spreading water
    on the contaminated surface and allow to evacuate through the sanitary system.
    Xanthine monosodium salt monohydrate

Section 7. Handling and Storage
    Precautions        Keep away from heat. Keep away from sources of ignition. Empty containers pose a fire risk, evaporate the    
    residue under a fume hood. Ground all equipment containing material. Do not breathe dust. Wear suitable
    protective clothing If you feel unwell, seek medical attention and show the label when possible. Avoid contact
    with skin and eyes
    Storage        Keep container dry. Keep in a cool place. Ground all equipment containing material. Keep container tightly    
    closed. Keep in a cool, well-ventilated place. Combustible materials should be stored away from extreme heat
    and away from strong oxidizing agents.

Section 8. Exposure Controls/Personal Protection
    Engineering Controls        Use process enclosures, local exhaust ventilation, or other engineering controls to keep airborne levels below    
    recommended exposure limits. If user operations generate dust, fume or mist, use ventilation to keep exposure to
    airborne contaminants below the exposure limit.
    Personal Protection        Splash goggles. Lab coat. Dust respirator. Be sure to use an approved/certified respirator or equivalent.    
    Gloves.
    Personal Protection in Case of Splash goggles. Full suit. Dust respirator. Boots. Gloves. A self contained breathing apparatus should be used
    a Large Spill        to avoid inhalation of the product. Suggested protective clothing might not be sufficient; consult a specialist    
    BEFORE handling this product.
    Exposure Limits        Not available.    

Section 9. Physical and Chemical Properties
    Physical state and appearance Solid. (Powdered solid.)        Odor        Not available.    
    Taste        Not available.    
    192.11 g/mole
    Molecular Weight
    Color        Colorless to light yellow.    
    pH (1% soln/water)        Not applicable.    
    Boiling Point        Not available.    
    Melting Point        Decomposes.    
    Critical Temperature        Not available.    
    Specific Gravity        Not available.    
    Not applicable.
    Vapor Pressure
    Vapor Density        5.3 (Air = 1)    
    Volatility        Not available.    
    Odor Threshold        Not available.    
    Water/Oil Dist. Coeff.        Not available.    
    Not available.
    Ionicity (in Water)
    Dispersion Properties        Not available.    
    Insoluble in cold water.
    Solubility

Section 10. Stability and Reactivity Data
    The product is stable.
    Stability
    Instability Temperature        Not available.    
    Not available.
    Conditions of Instability
    Incompatibility with various Not available.
    substances
    Xanthine monosodium salt monohydrate
    Corrosivity        Non-corrosive in presence of glass.    
    Special Remarks on        Not available.    
    Reactivity
    Special Remarks on        Not available.    
    Corrosivity
    Polymerization        No.    

Section 11. Toxicological Information
    Routes of Entry        Eye contact. Ingestion.    
    Toxicity to Animals        LD50: Not available.    
    LC50: Not available.
    Chronic Effects on Humans The substance is toxic to blood, kidneys, the nervous system.
    Other Toxic Effects on        Very hazardous in case of ingestion.    
    Humans        Hazardous in case of skin contact (irritant).    
    Slightly hazardous in case of inhalation.
    Special Remarks on        Not available.    
    Toxicity to Animals
    Special Remarks on        Passes through the placental barrier in animal.    
    Chronic Effects on Humans
    Special Remarks on other        Not available.    
    Toxic Effects on Humans

Section 12. Ecological Information
    Not available.
    Ecotoxicity
    Not available.
    BOD5 and COD
    Products of Biodegradation        Possibly hazardous short term degradation products are not likely. However, long term degradation products may    
    arise.
    Toxicity of the Products        The products of degradation are more toxic.    
    of Biodegradation
    Not available.
    Special Remarks on the
    Products of Biodegradation

Section 13. Disposal Considerations
    Waste Disposal

Section 14. Transport Information
    DOT Classification        Not a DOT controlled material (United States).    
    Not applicable.
    Identification
    Special Provisions for        Not applicable.    
    Transport
    Xanthine monosodium salt monohydrate
    DOT (Pictograms)

Section 15. Other Regulatory Information and Pictograms
    TSCA 8(b) inventory: Xanthine monosodium salt monohydrate
    Federal and State
    Regulations
    California
    Proposition 65
    Warnings
    Other Regulations        OSHA: Hazardous by definition of Hazard Communication Standard (29 CFR 1910.1200).    
    WHMIS (Canada) Not controlled under WHMIS (Canada).
    Other Classifications
    DSCL (EEC)        R36/38- Irritating to eyes and skin.    
    Health Hazard
    HMIS (U.S.A.)        2 National Fire Protection    
    1 Flammability
    1 Association (U.S.A.)
    Fire Hazard
    2 0 Reactivity
    Health
    Reactivity
    0
    Specific hazard
    Personal Protection
    E
    WHMIS (Canada)
    (Pictograms)
    DSCL (Europe)
    (Pictograms)
    TDG (Canada)
    (Pictograms)
    ADR (Europe)
    (Pictograms)
    Protective Equipment
    Gloves.
    Lab coat.
    Dust respirator. Be sure to use an
    approved/certified respirator or
    equivalent.
    Xanthine monosodium salt monohydrate


SECTION 16 - ADDITIONAL INFORMATION
N/A