272-49-1 (4-氮杂吲哚,4-Azaindole)

快速询单

结构式：

4-氮杂吲哚MOL文件

CAS号：

272-49-1

中文名称：

4-氮杂吲哚

英文名称：

4-Azaindole

安全信息：

分子式：

C₇H₆N₂

分子量：

118.135941028595

4-氮杂吲哚(272-49-1)名称与标识符

名称

中文别名：

4-氮杂吲哚;1H-吡咯并[3,2-b]吡啶;1H-Pyrrolo[3,2-b]pyridine 1H-吡咯并[3,2-b]吡啶;4-吖吲哚;4-氮吲哚;4-杂氮吲哚;

英文别名：

4-Azaindole;1H-Pyrrolo[3,2-b]pyridine;1H-Pyrrolo[3.2-b]pyridine;3H-pyrrolo[3,2-b]pyridine;4-Azindole;1,4-Diazaindene;4-Azaindole,1H-pyrrolo[3,2-b]pyridine;4-azanidole;PYRROLOPYRIDINE;272-49-1;BCP26719;SY019307;SCHEMBL12565;MFCD00971977;CHEMBL5184883;pyrrolo[3,2-b]pyridine;4JP;SCHEMBL16662494;XWIYUCRMWCHYJR-UHFFFAOYSA-N;Z1925930568;A-9485;5-23-06-00303 (Beilstein Handbook Reference);EN300-94605;1H-Pyrrolo(3,2-b)pyridine;AKOS005256883;W-204756;1H-pyrrolo[3,2-b]pyridine, AldrichCPR;HY-20362;CS-D1166;AC-088;PB18523;FT-0601479;4-Azaindole;4-Azaindole;BRN 0109683;PS-4925;SCHEMBL17850816;AM20051025;DTXSID00181666;BB 0260112;Q27454752;P2041;DB-016054;STL557476;BBL103666;DTXCID40104157;FA16127;674-574-1;1,4-Butanedioldiglycidylether;

标识符

MDL：

MFCD00971977

InChIKey：

XWIYUCRMWCHYJR-UHFFFAOYSA-N

Inchi：

1S/C7H6N2/c1-2-6-7(8-4-1)3-5-9-6/h1-5,9H

SMILES：

N1C=CC2=C1C=CC=N2

4-氮杂吲哚(272-49-1)物化性质

实验特性

LogP : 1.56290
PSA : 28.68000
折射率 : 1.697
水溶性 : Soluble in methanol and chloroform. Slightly soluble in water.
沸点 : 273.8°C at 760 mmHg
熔点 : 126.0 to 130.0 deg-C
闪点 : 124.8 oC
颜色与性状 : Yellow to Brown Solid
最大波长(λmax) : 288(lit.)
密度 : 1.242

计算特性

精确分子量 : 118.05300
氢键供体数量 : 1
氢键受体数量 : 2
可旋转化学键数量 : 0
同位素质量 : 118.053
重原子数量 : 9
复杂度 : 103
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） : 1.1
互变异构体数量 : 2
表面电荷 : 0
拓扑分子极性表面积 : 28.7A^2

4-氮杂吲哚(272-49-1)安全信息

符号： GHS07
RTECS号： UY8715000
安全说明： 26-39
危险品标志： Xi
危险品运输编号： NONH for all modes of transport
危害声明：H315-H319
警示性声明：P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
提示语：警告
储存条件： Keep in dark place,Inert atmosphere,Room temperature
危险类别码： 41
信号词： Danger
HazardClass： IRRITANT

4-氮杂吲哚(272-49-1)海关数据

海关编码：

29339980

海关数据：

中国海关编码：

29339980

4-氮杂吲哚(272-49-1)推荐厂家更多厂家(58)

公司名称	手机号/电话	联系人	QQ	询单
上海源叶生物科技有限公司	15026964105 15026964105	汤思磊	2881489226	询单
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JACS-郑州杰克斯化工产品有限公司	15981966935 0371-86259281	杰克斯JACS	893596907	询单
上海绩祥生物科技有限公司	13093077543	陆经理	3985448220	询单
湖北云镁科技有限公司	18327059871 027-59206672	方经理	235010015	询单
湖北诺纳科技有限公司	18995657604 027-59209883	吴经理	2933307129	询单
湖北诺纳科技有限公司	18995657604 027-59209883	吴经理	2933307129	询单
上海创赛科技有限公司	15021221957 021-59553580	凌度	2852351983	询单

4-氮杂吲哚(272-49-1)上下游

4-氮杂吲哚-4-氧化物 3-溴-4-氮杂吲哚胺碘酮盐酸盐 7-氮杂吲哚-7-氧化物 6-氯-7-氮杂吲哚

4-氮杂吲哚(272-49-1)相关文献

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8. Coexistence of an antiferromagnetically coupled dimer and isolated paramagnetic spin in 4-azaindol-2-yl nitronyl nitroxide crystal
Hideaki Nagashima,Noriko Hashimoto,Hidenari Inoue,Naoki Yoshioka New J. Chem. 2003 27 805
9. Synthesis and biological evaluation of 2,3-bis(het)aryl-4-azaindole derivatives as protein kinase inhibitors
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10. Recent developments in the synthesis of azaindoles from pyridine and pyrrole building blocks
Damoder Reddy Motati,Radhika Amaradhi,Thota Ganesh Org. Chem. Front. 2021 8 466

4-氮杂吲哚(272-49-1)参考资料

Reaxys RN：

109683

Beilstein：

MFCD00971977

PubChem CID：

253661041

4-氮杂吲哚(272-49-1) MSDS

基础信息

Material Safety Data Sheet

Section 1. Identi?cation of the substance
Product Name: 4-Azaindole
Synonyms:

Section 2. Hazards identi?cation
Harmful by inhalation, in contact with skin, and if swallowed.

Section 3. Composition/information on ingredients.
Ingredient name: 4-Azaindole
CAS number: 272-49-1

Section 4. First aid measures
    Skin contact:        Immediately wash skin with copious amounts of water for at least 15 minutes while removing
    contaminated clothing and shoes. If irritation persists, seek medical attention.
    Eye contact:        Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate
    ?ushing of the eyes by separating the eyelids with ?ngers. If irritation persists, seek medical
    attention.
    Inhalation:        Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.
    Ingestion:        Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.

Section 5. Fire ?ghting measures
    In the event of a ?re involving this material, alone or in combination with other materials, use dry
    powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
    should be worn.

Section 6. Accidental release measures
    Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
    standards.
    Respiratory precaution:        Wear approved mask/respirator
    Hand precaution:        Wear suitable gloves/gauntlets
    Skin protection:        Wear suitable protective clothing
    Eye protection:        Wear suitable eye protection
    Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
    for disposal. See section 12.
    Environmental precautions: Do not allow material to enter drains or water courses.

Section 7. Handling and storage
    Handling:        This product should be handled only by, or under the close supervision of, those properly quali?ed
    in the handling and use of potentially hazardous chemicals, who should take into account the ?re,
    health and chemical hazard data given on this sheet.
    Store in closed vessels, refrigerated.
    Storage:

Section 8. Exposure Controls / Personal protection
    Engineering Controls: Use only in a chemical fume hood.
    Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
    General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

Section 9. Physical and chemical properties
    Appearance:        Not speci?ed
    Boiling point:        No data
    No data
    Melting point:
    Flash point:        No data
    Density:        No data
    Molecular formula:        C7H6N2
    Molecular weight:        118.1

Section 10. Stability and reactivity
    Conditions to avoid: Heat, ?ames and sparks.
    Materials to avoid: Oxidizing agents.
    Possible hazardous combustion products: Carbon monoxide, nitrogen oxides.

Section 11. Toxicological information
No data.

Section 12. Ecological information
No data.

Section 13. Disposal consideration
Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
disposal authority, in accordance with national and regional regulations.

Section 14. Transportation information
Non-harzardous for air and ground transportation.

Section 15. Regulatory information
    No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
    302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
    Title III, Section 313.

SECTION 16 - ADDITIONAL INFORMATION
N/A