25981-83-3 (5-氯-2,3,3-三甲基吲哚,5-Chloro-2,3,3-trimethyl-3H-indole)

快速询单

结构式：

5-氯-2,3,3-三甲基吲哚MOL文件

CAS号：

25981-83-3

中文名称：

5-氯-2,3,3-三甲基吲哚

英文名称：

5-Chloro-2,3,3-trimethyl-3H-indole

分子式：

C₁₁H₁₂ClN

分子量：

193.672681808472

5-氯-2,3,3-三甲基吲哚(25981-83-3)名称与标识符

名称

中文别名：

5-氯-2,3,3-三甲基吲哚;5-氯-2,3,3-三甲基-3H-吲哚;2,3,3-三甲基-5-氯-3H-吲哚;2,3,3-三甲基-5-氯-假吲哚;2,2-亚甲基双[6-(1-苯基乙基)-4-甲酚];

英文别名：

5-Chloro-2,3,3-trimethyl-3H-indole;2,3,3-TRIMETHYL-5-CHLORO-3H-INDOLE;5-chloro-2,3,3-trimethylindole;2,2-METHYLENEBIS[6-(1-PHENYLETHYL)-P-CRESOL];2,3,3-trimethyl indolenine-5-chloride;2,3,3-trimethyl-5-chloroindolenine;2-chloro-2,3,3-trimethyl-3H-indole;5-chloro-2,3,3-trimethyl-3-hydroindole;5-Chloro-2.3.3-trimethyl-indolenine;chloroindolenine;EINECS 247-387-4;SB36242;SCHEMBL1714750;AKOS005259060;NS00028012;FT-0602530;AC-19071;SY018327;T-6630;2,3,3-Trimethyl-5-chloro-3-H-indole;PS-8310;GSKATGIMEUGNJN-UHFFFAOYSA-N;CS-0152765;25981-83-3;3H-Indole, 5-chloro-2,3,3-trimethyl-;DTXSID1067170;5-Chloro-2,3,3-trimethylindolenine;5-CHLORO-2,3,3-TRIMETHYLINDOLINE;MFCD00126966;DTXCID2037427;DB-046808;

标识符

MDL：

MFCD00126966

InChIKey：

GSKATGIMEUGNJN-UHFFFAOYSA-N

Inchi：

1S/C11H12ClN/c1-7-11(2,3)9-6-8(12)4-5-10(9)13-7/h4-6H,1-3H3

SMILES：

ClC1C=CC2=C(C=1)C(C)(C)C(C)=N2

5-氯-2,3,3-三甲基吲哚(25981-83-3)物化性质

实验特性

LogP : 3.15920
PSA : 12.36000
折射率 : n20/D 1.594(lit.)
沸点 : 271.1°C at 760 mmHg
闪点 : >230 °F
颜色与性状 : 油状液体色
密度 : 1.083 g/mL at 25 °C(lit.)

计算特性

精确分子量 : 193.06600
氢键供体数量 : 0
氢键受体数量 : 1
可旋转化学键数量 : 0
同位素质量 : 193.066
重原子数量 : 13
复杂度 : 245
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） : 2.9
拓扑分子极性表面积 : 12.4A^2

5-氯-2,3,3-三甲基吲哚(25981-83-3)安全信息

WGK Germany： 3
安全说明： S26; S37/39
风险术语： R36/37/38
危险品标志： Xi
危害声明：H315-H319-H335
警示性声明：P261; P264; P271; P280; P302+P352; P304+P340; P305+P351+P338; P312; P321; P332+P313; P337+P313; P362; P403+P233; P405; P501
储存条件： Keep in dark place,Inert atmosphere,2-8°C
危险类别码： 36/37/38
信号词： Warning

5-氯-2,3,3-三甲基吲哚(25981-83-3)国际标准相关数据

EINECS：

247-387-4

5-氯-2,3,3-三甲基吲哚(25981-83-3)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%

5-氯-2,3,3-三甲基吲哚(25981-83-3)推荐厂家更多厂家(51)

公司名称	手机号/电话	联系人	QQ	询单
湖北成海化工有限公司	13986212397 027-59220433	张思胧	1400858822	询单
江苏新素新材料有限公司	13914000513 0512-66387919	孙文婷	3771156959	询单
山东玖玥生物科技有限公司	15553333686	张文杰	643971	询单
湖北摆渡化学有限公司	13517219350 13517219350	彭星	1400878899	询单
湖北拓邦化工有限公司	15102763473 027-59106185	涂梦婷	1400868822/1248089955	询单
湖北广奥生物科技有限公司	13657291602 13657291602	郭银	1098480033	询单
湖北信康医药化工有限公司	13476235517 13476235517	杨彩云	1438280055	询单
湖北鑫红利化工有限公司	15172537016 027-59503710	吕经理	1018283355	询单
湖北实顺生物科技有限公司	15107128801 15107128801	郑雨晗	1400818899	询单
巨胜化学研究院	18064118002 027-59599240	陈盼	1400838822	询单

5-氯-2,3,3-三甲基吲哚(25981-83-3)上下游

对氯苯胺 4-氯苯肼对氯苯肼盐酸盐 4,4-dimethyl-5-methylidene-1,3-dioxolan-2-one 3-甲基-2-丁酮

5-氯-2,3,3-三甲基吲哚(25981-83-3)相关文献

1. Zirconium-hydride-catalyzed transfer hydrogenation of quinolines and indoles with ammonia borane
Xin Cui,Wei Huang,Lipeng Wu Org. Chem. Front. 2021 8 5002

5-氯-2,3,3-三甲基吲哚(25981-83-3)参考资料

Beilstein：

C183223

PubChem CID：

117694

5-氯-2,3,3-三甲基吲哚(25981-83-3) MSDS

基础信息

Material Safety Data Sheet

Section 1. Identi?cation of the substance
Product Name: 5-Chloro-2,3,3-trimethyl-3H-indole
Synonyms:

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

Section 3. Composition/information on ingredients.
Ingredient name: 5-Chloro-2,3,3-trimethyl-3H-indole
CAS number: 25981-83-3

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:        C11H12ClN
    Molecular weight:        193.7

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, hydrogen chloride.

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