5-Nitroquinoline-2-carboxylic acid

5-Nitroquinoline-2-carboxylic acid 基本信息
CAS号 525-47-3 分子式 C10H6N2O4
分子量 218.16600 精确质量  218.03300
PSA  96.01000 LogP  2.36440

基本信息 展开↓

CAS号:
525-47-3
3D弹球模型:
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分子式:
C10H6N2O4
分子量:
218.16600
中文名称:
5-Nitroquinoline-2-carboxylic acid
英文名称:
5-Nitroquinoline-2-carboxylic acid
中文别名:
5-Nitroquinoline-2-carboxylic acid
英文别名:
5-Nitroquinoline-2-carboxylic acid;
5-NITROQUINALDIC ACID;
5-Nitro-2-quinolinecarboxylic acid;
EINECS 208-372-8;
2-Quinolinecarboxylic acid,5-nitro;
5-Nitroquinaldinic acid;
Quinaldic acid,5-nitro
精确分子量/精确质量:
218.03300
极性分子表面积/PSA:
96.01000
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:
208-372-8
InChI:
The Key: PHELEJSJZGCLEJ-UHFFFAOYSA-N

物化性质展开↓

密度:
1.545g/cm3
沸点:
431.1ºC at 760mmHg
闪点:
214.5ºC
折射率:
1.718

安全信息展开↓

海关代码:
2933499090

合成路线查看所有的合成路线

  • 93-10-7

    喹哪啶酸

  • 525-47-3

    5-Nitroquinoline-2-carboxylic acid

  • 93-10-7

    喹哪啶酸

  • 525-47-3

    5-Nitroquinoline-2-carboxylic acid

  • +

  • 15733-85-4

    8-nitroquinoline-2-carboxylic acid

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UZ9580000
CHEMICAL NAME :
Quinaldic acid, 5-nitro-
CAS REGISTRY NUMBER :
525-47-3
BEILSTEIN REFERENCE NO. :
0188433
LAST UPDATED :
199709
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H6-N2-O4
MOLECULAR WEIGHT :
218.18
WISWESSER LINE NOTATION :
T66 BNJ CVQ GNW

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
1 umol/plate
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 58,11,1978

MSDS 展开↓

    Version 1.2
    Regulation (EC) No 1907/2006

    1 - Product and Company Information

    Product Name        5-NITROQUINALDIC ACID - 25 MG    

    2 - Hazards Identification

    3 - Composition/Information on Ingredients

    Product Name        CAS #        EC no        Annex I    
    Index Number
    5-NITROQUINALDIC ACID, 99%        525-47-3 208-372-8 None    
    Formula        C10H6N2O4    
    Molecular Weight 218,1700 AMU
    Synonyms        5-Nitroquinaldic acid * 5-Nitroquinaldinic acid    
    * 5-Nitro-2-quinolinecarboxylic acid *
    2-Quinolinecarboxylic acid, 5-nitro- (9CI)

    4 - First Aid Measures

    AFTER INHALATION
    If inhaled, remove to fresh air. If not breathing give
    artificial respiration. If breathing is difficult, give oxygen.
    AFTER INGESTION
    If swallowed, wash out mouth with water provided person is
    conscious. Call a physician.

    5 - Fire Fighting Measures

    EXTINGUISHING MEDIA
    Suitable: Water spray. Carbon dioxide, dry chemical powder, or
    appropriate foam.
    SPECIAL RISKS
    Specific Hazard(s): Emits toxic fumes under fire conditions.
    SPECIAL PROTECTIVE EQUIPMENT FOR FIREFIGHTERS
    Wear self-contained breathing apparatus and protective clothing
    ALDRICH        www.molbase.com    
    to prevent contact with skin and eyes.

    6 - Accidental Release Measures

    PERSONAL PRECAUTION PROCEDURES TO BE FOLLOWED IN CASE OF LEAK OR SPILL
    Evacuate area.
    PROCEDURE(S) OF PERSONAL PRECAUTION(S)
    Wear self-contained breathing apparatus, rubber boots, and heavy
    rubber gloves.
    METHODS FOR CLEANING UP
    Sweep up, place in a bag and hold for waste disposal. Avoid
    raising dust. Ventilate area and wash spill site after material
    pickup is complete.

    7 - Handling and Storage

    HANDLING
    Directions for Safe Handling: Do not breathe dust. Do not get in
    eyes, on skin, on clothing. Avoid prolonged or repeated exposure.
    STORAGE
    Conditions of Storage: Keep tightly closed. Store in a cool dry
    place.

    8 - Exposure Controls / Personal Protection

    ENGINEERING CONTROLS
    Use only in a chemical fume hood. Safety shower and eye bath.
    GENERAL HYGIENE MEASURES
    Wash thoroughly after handling. Wash contaminated clothing before
    reuse.
    PERSONAL PROTECTIVE EQUIPMENT
    Special Protective Measures: Wear appropriate government approved
    respirator, chemical-resistant gloves, safety goggles, other
    protective clothing.

    9 - Physical and Chemical Properties

    pH N/A
    BP/BP Range        N/A    
    MP/MP Range        203,000 °C    
    Flash Point        N/A    
    Flammability        N/A    
    Autoignition Temp        N/A    
    Oxidizing Properties N/A
    Explosive Properties N/A
    Explosion Limits        N/A    
    Vapor Pressure        N/A    
    Partition Coefficient N/A
    Viscosity        N/A    
    Vapor Density        N/A    
    Saturated Vapor Conc. N/A
    Evaporation Rate        N/A    
    Bulk Density        N/A    
    Decomposition Temp.        N/A    
    Solvent Content        N/A    
    ALDRICH        www.molbase.com    
    Water Content        N/A    
    Surface Tension        N/A    
    Conductivity        N/A    
    Miscellaneous Data        N/A    
    Solubility        N/A    

    10 - Stability and Reactivity

    STABILITY
    Materials to Avoid: Strong oxidizing agents, Strong bases.
    HAZARDOUS DECOMPOSITION PRODUCTS
    Hazardous Decomposition Products: Carbon monoxide, Carbon dioxide,
    Nitrogen oxides.

    11 - Toxicological Information

    RTECS NUMBER: UZ9580000
    SIGNS AND SYMPTOMS OF EXPOSURE
    To the best of our knowledge, the chemical, physical, and
    toxicological properties have not been thoroughly investigated.
    ROUTE OF EXPOSURE
    Multiple Routes: Harmful if swallowed, inhaled, or absorbed
    through skin. May cause irritation.
    CHRONIC EXPOSURE - MUTAGEN
    ZPOS
    Histidine reversion (Ames)

    12 - Ecological Information

    No data available.

    13 - Disposal Considerations

    SUBSTANCE DISPOSAL
    Dissolve or mix the material with a combustible solvent and burn
    in a chemical incinerator equipped with an afterburner and
    scrubber. Observe all federal, state, and local environmental
    regulations.

    14 - Transport Information

    RID/ADR
    Non-hazardous for road transport.
    IMDG
    Non-hazardous for sea transport.
    IATA
    Non-hazardous for air transport.

    15 - Regulatory Information

    COUNTRY SPECIFIC INFORMATION
    Germany
    ALDRICH        www.molbase.com    
    WGK: 3
    Self-Classification

    16 - Other Information

    WARRANTY
    The above information is believed to be correct but does not
    purport to be all inclusive and shall be used only as a guide. The
    information in this document is based on the present state of our
    knowledge and is applicable to the product with regard to
    appropriate safety precautions. It does not represent any
    guarantee of the properties of the product. Inc.,
    shall not be held liable for any damage resulting from handling or
    from contact with the above product. See reverse side of invoice
    or packing slip for additional terms and conditions of sale.
    Copyright 2010 Co. License granted to make
    unlimitedpaper copies for internal use only.
    DISCLAIMER
    For R&D use only. Not for drug, household or other uses.
    ALDRICH        www.molbase.com    


SECTION 16 - ADDITIONAL INFORMATION
N/A

海关数据查看详细

中国海关编码:2933499090

概述:
2933499090. 其他含喹琳或异喹啉环系的化合物〔但未进一步稠合的〕. 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
摘要/Summary:
2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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