5(4H)-Oxazolone,4-[(4-fluorophenyl)methylene]-2-phenyl-

5(4H)-Oxazolone,4-[(4-fluorophenyl)methylene]-2-phenyl- 基本信息
CAS号 449-81-0 分子式 C16H10FNO2
分子量 267.25500 精确质量  267.07000
PSA  38.66000 LogP  2.60580

基本信息 展开↓

CAS号:
449-81-0
3D弹球模型:
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分子式:
C16H10FNO2
分子量:
267.25500
英文名称:
5(4H)-Oxazolone,4-[(4-fluorophenyl)methylene]-2-phenyl-
英文别名:
5(4H)-Oxazolone,4-[(4-fluorophenyl)methylene]-2-phenyl-;
4-(4-fluorobenzylidene)-2-phenyloxazol-5(4H)-one;
2-Phenyl-4-(4-fluorobenzylidene)-2-oxazoline-5-one;
4-[(4-fluorophenyl)methylene]-2-phenyloxazol-5(4H)-one;
2-Phenyl-4-(4-fluorobenzylidene)oxazole-5(4H)-one;
4-[(4-Fluorophenyl)methylene]-2-phenyl-2-oxazolin-5-one;
4-(4-fluorobenzyliden)-2-phenyl-5(4H)-oxazolone;
4-(4-fluorobenzylidene)-2-phenyl-5(4H)-oxazolone;
4-(4-fluorobenzylidene)-2-phenyloxazol-5-one;
(Z/E)-4-(4-fluorobenzylidene)-2-phenyl-1,3-oxazol-5(4H)-one
精确分子量/精确质量:
267.07000
极性分子表面积/PSA:
38.66000
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:
207-189-0
InChI:
The Key: GGMAOSAZKMNBHB-UHFFFAOYSA-N

物化性质展开↓

密度:
1.23g/cm3
沸点:
385.6ºC at 760mmHg
闪点:
187ºC
折射率:
1.598
蒸汽压:
3.76E-06mmHg at 25°C

安全信息展开↓

海关代码:
2934999090

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RQ5796000
CHEMICAL NAME :
2-Oxazolin-5-one, 4-(p-fluorobenzylidene)-2-phenyl-
CAS REGISTRY NUMBER :
449-81-0
LAST UPDATED :
197901
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H10-F-N-O2
MOLECULAR WEIGHT :
267.27
WISWESSER LINE NOTATION :
T5NYVOJ BU1R DF& ER

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#00387

MSDS 展开↓

    Version 1.2
    Regulation (EC) No 1907/2006

    1 - Product and Company Information

    Product Name        4-(4-FLUOROBENZYLIDENE)-2-PHENYL-2-OXAZ&    

    2 - Hazards Identification

    3 - Composition/Information on Ingredients

    Product Name        CAS #        EC no        Annex I    
    Index Number
    4-(4-FLUOROBENZYLIDENE)-2-PHENYL-2 449-81-0 207-189-0 None
    -OXAZOLIN-5-ONE
    Formula        C16H10FNO2    
    Molecular Weight 267,2600 AMU
    Synonyms        4-(p-Fluorobenzylidene)-2-phenyl-2-oxazolin-5-one    

    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 SKIN CONTACT
    In case of contact, immediately wash skin with soap and copious
    amounts of water.
    AFTER EYE CONTACT
    In case of contact, immediately flush eyes with copious amounts
    of water for at least 15 minutes.
    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
    ALDRICH        www.molbase.com    
    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
    to prevent contact with skin and eyes.

    6 - Accidental Release Measures

    PROCEDURE(S) OF PERSONAL PRECAUTION(S)
    Wear respirator, chemical safety goggles, 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: Avoid inhalation. Avoid contact
    with eyes, skin, and 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
    Safety shower and eye bath. Mechanical exhaust required.
    GENERAL HYGIENE MEASURES
    Wash thoroughly after handling. Wash contaminated clothing before
    reuse.
    PERSONAL PROTECTIVE EQUIPMENT
    Respiratory Protection: Use respirators and components tested and
    approved under appropriate government standards such as NIOSH (US)
    or CEN (EU). Respiratory protection is not required. Where
    protection is desired, use multi-purpose combination (US) or type
    ABEK (EN 14387) respirator cartridges.
    Hand Protection: Compatible chemical-resistant gloves.
    Eye Protection: Chemical safety goggles.

    9 - Physical and Chemical Properties

    pH N/A
    BP/BP Range        N/A    
    MP/MP Range        184,000. - 186,000 °    
    C.
    Flash Point        N/A    
    Flammability        N/A    
    Autoignition Temp        N/A    
    Oxidizing Properties N/A
    Explosive Properties N/A
    ALDRICH        www.molbase.com    
    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    
    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.
    HAZARDOUS DECOMPOSITION PRODUCTS
    Hazardous Decomposition Products: Carbon monoxide, Carbon dioxide,
    Nitrogen oxides, Hydrogen fluoride.

    11 - Toxicological Information

    RTECS NUMBER: RQ5796000
    ACUTE TOXICITY
    LD50
    Intravenous
    Mouse
    100 MG/KG
    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
    Skin Contact: May cause skin irritation.
    Eye Contact: May cause eye irritation.
    Multiple Routes: May be harmful by inhalation, ingestion, or
    skin absorption.

    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

    ALDRICH        www.molbase.com    
    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
    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:2934999090

概述:
2934999090. 其他杂环化合物. 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
摘要/Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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