3589-72-8 (6-甲氧基哈尔满,6-methoxy-1-methyl-9H-pyrido3,4-bindole)

CAS号:
3589-72-8
中文名称:
6-甲氧基哈尔满
英文名称:
6-methoxy-1-methyl-9H-pyrido3,4-bindole
分子式:
C13H12N2O
分子量:
212.247182846069

6-甲氧基哈尔满(3589-72-8)名称与标识符

名称

中文别名:
6-甲氧基哈尔满;
英文别名:
6-methoxy-1-methyl-9H-Pyrido[3,4-b]indole;9H-Pyrido[3,4-b]indole,6-methoxy-1-methyl-;6-Methoxy Harman;6-Methoxyharmane;Coharmine;Isoharmine;9H-Pyrido(3,4-b)indole, 6-methoxy-1-methyl-;6-Methoxy-1-methyl-9H-pyrido(3,4-b)indole;48GQI7H930;NSC92536;Oprea1_024115;XYYVPBBISSKKQB-UHFFFAOYSA-N;BDBM50132122;6-Methoxy-1-methyl-9H-beta-carboline;.beta.-Carboline, 6-methoxy-1-methyl-;6-methoxy-1-methyl-9H-pyrido3,4-bindole;Q15426262;D72284;UNII-48GQI7H930;DTXSID40189449;AKOS037651093;NSC-92536;4-23-00-02701 (Beilstein Handbook Reference);CS-15875;6-Methoxyharman;3589-72-8;6-Methoxy-1-methyl-9H-beta-carboline #;SCHEMBL5035404;CHEMBL278193;CS-0062557;BRN 0178687;NSC 92536;DS-009456;

标识符

MDL:
MFCD01544241
InChIKey:
XYYVPBBISSKKQB-UHFFFAOYSA-N
Inchi:
1S/C13H12N2O/c1-8-13-10(5-6-14-8)11-7-9(16-2)3-4-12(11)15-13/h3-7,15H,1-2H3
SMILES:
O(C)C1C=CC2=C(C=1)C1C=CN=C(C)C=1N2
BRN:
0178687

6-甲氧基哈尔满(3589-72-8)物化性质

实验特性

  • LogP : 3.03310
  • PSA : 37.91000
  • 折射率 : 1.706
  • 沸点 : 421.4°Cat760mmHg
  • 熔点 : 275°C (dec.)
  • 闪点 : 139.7°C
  • 密度 : 1.252

计算特性

  • 精确分子量 : 212.09500
  • 氢键供体数量 : 1
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 1
  • 同位素质量 : 212.094963
  • 重原子数量 : 16
  • 复杂度 : 258
  • 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) : 3.6
  • 拓扑分子极性表面积 : 37.9

6-甲氧基哈尔满(3589-72-8)安全信息

6-甲氧基哈尔满(3589-72-8)国际标准相关数据

EINECS:
92536

6-甲氧基哈尔满(3589-72-8)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%

6-甲氧基哈尔满(3589-72-8)推荐厂家 更多厂家(8)

公司名称手机号/电话联系人QQ微信询单
上海瀚思化工有限公司 18939883912
021-34536277
顾经理 3003949364
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江苏艾康生物医药研发有限公司 18795912720
025-66061636
杨情情 3004779232
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上海麦克林生化科技股份有限公司 15221275939
021-50706066
沈经理 269348414
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上海吉至生化科技有限公司 18117592386
021-57481218
吉至试剂 3007522982
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上海吉至生化科技有限公司 18117592386
021-57481218
吉至试剂 3007522982
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上海吉至生化科技有限公司 18117592386
021-57481218
吉至试剂 3007522982
询单
北京华威锐科化工有限公司 13269663372
010-89508211
李爽 2853391965
询单
上海源叶生物科技有限公司 15026964105
15026964105
汤思磊 2881489226
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6-甲氧基哈尔满(3589-72-8)相关文献

6-甲氧基哈尔满(3589-72-8) MSDS

基础信息

    Version 1.2
    Regulation (EC) No 1907/2006

    1 - Product and Company Information

    Product Name        6-METHOXYHARMAN    

    2 - Hazards Identification

    3 - Composition/Information on Ingredients

    Product Name        CAS #        EC no        Annex I    
    Index Number
    6-METHOXYHARMAN        3589-72-8 None        None    
    Formula        C13H12N2O    
    Molecular Weight 212,3000 AMU
    Synonyms        Coharmine * Isoharmine * 6-Methoxyharman *    
    6-Methoxyharmane *
    6-Methoxy-1-methyl-9H-pyrido(3,4-b)indole

    4 - First Aid Measures

    AFTER INHALATION
    If inhaled, remove to fresh air. If breathing becomes difficult,
    call a physician.
    AFTER SKIN CONTACT
    In case of skin contact, flush with copious amounts of water for
    at least 15 minutes. Remove contaminated clothing and shoes.
    Call a physician.
    AFTER EYE CONTACT
    In case of contact with eyes, flush with copious amounts of
    water for at least 15 minutes. Assure adequate flushing by
    separating the eyelids with fingers. Call a physician.
    AFTER INGESTION
    If swallowed, wash out mouth with water provided person is
    conscious. Call a physician.

    5 - Fire Fighting Measures
    SIGMA        www.molbase.com    

    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
    to prevent contact with skin and eyes.

    6 - Accidental Release Measures

    PROCEDURE(S) OF PERSONAL PRECAUTION(S)
    Wear protective equipment.
    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

    STORAGE
    Store at 2-8°C

    8 - Exposure Controls / Personal Protection

    ENGINEERING CONTROLS
    Mechanical exhaust required.
    PERSONAL PROTECTIVE EQUIPMENT
    Special Protective Measures: Wear appropriate government approved
    respirator, chemical-resistant gloves, safety goggles, other
    protective clothing.

    9 - Physical and Chemical Properties

    Appearance        Physical State: Solid    
    Property        Value        At Temperature or Pressure    
    pH        N/A    
    BP/BP Range        N/A    
    MP/MP Range        N/A    
    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    
    SIGMA        www.molbase.com    
    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
    Stable: Stable.
    HAZARDOUS DECOMPOSITION PRODUCTS
    Hazardous Decomposition Products: Carbon monoxide, carbon dioxide,
    and nitrogen oxides.
    HAZARDOUS POLYMERIZATION
    Hazardous Polymerization: Will not occur

    11 - Toxicological Information

    RTECS NUMBER: UV0168000
    ACUTE TOXICITY
    LD50
    Intraperitoneal
    Mouse
    650 MG/KG
    Remarks: Kidney, Ureter, Bladder:Urine volume increased.
    ROUTE OF EXPOSURE
    Multiple Routes: May be harmful by inhalation, ingestion, or
    skin absorption. May cause irritation.
    CONDITIONS AGGRAVATED BY EXPOSURE
    The toxicological properties have not been thoroughly
    investigated.

    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
    SIGMA        www.molbase.com    
    Non-hazardous for air transport.

    15 - Regulatory Information

    Caution: Substance not yet fully tested (EU).
    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.
    SIGMA        www.molbase.com    


SECTION 16 - ADDITIONAL INFORMATION
N/A