反-1,2-二(2-噻吩基)乙烯

反-1,2-二(2-噻吩基)乙烯 基本信息
CAS号 13640-78-3 分子式 C10H16S2
分子量 200.36400 精确质量 　200.06900
PSA 　50.60000 LogP 　3.33380
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等价的CAS号：

13640-78-3,15332-30-6,18266-94-9,34512-02-2,109958-97-6
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目录
基本信息 物化性质 安全信息 合成路线 MSDS 海关数据 结构与计算数据 上下游

基本信息 展开↓

CAS号：
13640-78-3
3D弹球模型：
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分子式：
C10H16S2
分子量：
200.36400
中文名称：
反-1,2-二(2-噻吩基)乙烯
英文名称：
TRANS-1,2-DI(2-THIENYL)ETHYLENE
中文别名：
反-1,2-二(2-噻吩基)乙烯;
n,n-dimethyl-3-(2-thienyl)-3-hydroxypropanamine;
3-(dimethylamino)-1-(thiophen-2-yl)propan-1-ol;
2-hydrazinylbenzoic acid;
N,N-Dimethyl-3-hydroxy-3-(2-thienyl)propanamine;
3-(Dimethylamino)-1-(2-thienyl)-1-propanol;
1-BROMO-4-PHENYL-BUTANE >97%;
PBB;
(4-Bromo-butyl)-benzene;
4-Phenyl-1-Butyl Bromide;
1-Bromo-4-phenylbutane;
(2E)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one oxime;
D-Camphor oxime;
Blocklin L;
CCRIS 9215;
Calvisken;
Carvisken;
Decreten;
Durapindol;
Glauco-Viskin;
HSDB 6539;
LB 46;
Pectobloc;
Pinbetol;
Pindololum;
Pindololum [INN-Latin];
Prinodolol;
Pynastin;
UNII-BJ4HF6IU1D;
Visken;
(1)-1-(1H-Indol-4-yloxy)-3-(isopropylamino)propan-2-ol;
2-Propanol, 1-(1H-indol-4-yloxy)-3-((1-methylethyl)amino)-;
2-Propanol, 1-(indol-4-yloxy)-3-(isopropylamino)-, (+-)-;
1-(1H-indol-4-yloxy)-3-(propan-2-ylamino)propan-2-ol;
(2S)-2-hydroxy-3-(1H-indol-4-yloxy)-N-(1-methylethyl)propan-1-aminium;
(2R)-2-hydroxy-3-(1H-indol-4-ylo
英文别名：
TRANS-1,2-DI(2-THIENYL)ETHYLENE;
trans-1,2-Di(2-thienyl)ethylene;
Dithienylethylene
精确分子量/精确质量：
200.06900
极性分子表面积/PSA：
50.60000
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。
InChI：
InChI=1/C10H8S2/c1-3-9(11-7-1)5-6-10-4-2-8-12-10/h1-8H/b6-5+

物化性质展开↓

密度：
1.268g/cm3
熔点：
133ºC
沸点：
302.4ºC at 760 mmHg
闪点：
100.5ºC
折射率：
1.728
蒸汽压：
0.00178mmHg at 25°C
其它信息：

1.       性状：未确定

2.       密度（g/mL,25/4℃）：未确定

3.       相对蒸汽密度（g/mL,空气=1）：未确定

4.       熔点（ºC）：133

5.       沸点（ºC,常压）：未确定

6.       沸点（ºC,5.2kPa）：未确定

7.       折射率：未确定

8.       闪点（ºC）：未确定

9.       比旋光度（º）：未确定

10.    自燃点或引燃温度（ºC）：未确定

11.    蒸气压（kPa,25ºC）：未确定

12.    饱和蒸气压（kPa,60ºC）：未确定

13.    燃烧热（KJ/mol）：未确定

14.    临界温度（ºC）：未确定

15.    临界压力（KPa）：未确定

16.    油水（辛醇/水）分配系数的对数值：未确定

17.    爆炸上限（%,V/V）：未确定

18.    爆炸下限（%,V/V）：未确定

19.    溶解性：未确定

安全信息展开↓

海关代码：
2934999090

合成路线查看所有的合成路线

  • 98-03-3

    2-噻吩甲醛

  • →

    ~97%

  • 13640-78-3

    反-1,2-二(2-噻吩基)乙烯

  • 98-03-3

    2-噻吩甲醛

  • →

    ~82%

  • 18266-94-9

    顺-1,2-(2-噻嗯基)二乙烯

  • +

  • 13640-78-3

    反-1,2-二(2-噻吩基)乙烯

  • 1003-09-4

    2-溴噻吩

  • +

  • 156-60-5

    反式-1,2-二氯乙烯

  • →

    ~68%

  • 13640-78-3

    反-1,2-二(2-噻吩基)乙烯

MSDS 展开↓

Section I.Chemical Product and Company Identification
    Chemical Name trans-1,2-Di(2-thienyl)ethylene
    Portland OR
    Synonym
    3,3'-(1,2-Ethenediyl)bis-thiophene
    Chemical Formula
    C 10 H 8 S 2
    CAS Number
    13640-78-3
    (International)
Section II.        Composition and Information on Ingredients    
    Chemical Name        CAS Number Percent (%)        TLV/PEL        Toxicology Data    
    trans-1,2-Di(2-thienyl)ethylene        Min. 98.0 (GC)        Not available.        Not available.    
    13640-78-3
Section III.        Hazards Identification    
    Acute Health Effects
    N o specific inform ation is available in our data base regarding the toxic effects of this m aterial for hum ans. H ow ever,
    exposure to any chem ical should be kept to a m inim u m . Skin and eye contact m ay result in irritation. M ay be harm ful if
    inhaled or ingested. A lw ays follow safe industrial hygiene practices and w ear proper protective equipm ent w hen
    handling this com pound. Follow safe industrial hygiene practices and alw ays w ear proper protective equipm ent w hen
    handling this compound.
    Chronic Health Effects        CARCINOGENIC EFFECTS : Not available.    
    MUTAGENIC EFFECTS : Not available.
    TERATOGENIC EFFECTS : Not available.
    DEVELOPMENTAL TOXICITY : Not available.
    Repeated or prolonged exposure to this compound is not known to aggravate existing medical conditions.
Section IV.        First Aid Measures    
    Eye Contact
    C heck for and rem ove any contact lenses. In case of contact, im m ediately flush eyes w ith plenty of w ater for at least 15
    minutes. Get medical attention.
    Skin Contact
    In case of contact, im m ediately flush skin w ith plenty of w ater. Rem ove contam inated clothing and shoes. W ash
    clothing before reuse. Thoroughly clean shoes before reuse. Get medical attention.
    Inhalation
    If the victim is not breathing, perform m outh-to-m outh resuscitation. Loosen tight clothing such as a collar, tie, belt or
    w aistband. If breathing is difficult, oxygen can be adm inistered. Seek m edical attention if respiration problem s do not
    improve.
    Ingestion
    IN D U C E V O M ITIN G by sticking finger in throat. Low er the head so that the vom it w ill not reenter the m outh and throat.
    Loosen tight clothing such as a collar, tie, belt or w aistband. If the victim is not breathing, perform m outh-to-m outh
    resuscitation. Exam ine the lips and m outh to ascertain w hether the tissues are dam aged, a possible in dication that the
    toxic m aterial w as ingested; the absence of such signs, how ever, is not conclusive. SEEK IM M ED IA TE M ED IC A L
    ATTENTION in case of ingestion of a radioactive material.
Section V.        Fire and Explosion Data    
    Flammability        Auto-Ignition        Not available.    
    May be combustible at high temperature.
    Flammable Limits
    Flash Points
    Not available.
    Not available.
    Combustion Products
    These products are toxic carbon oxides (CO, CO        2), sulfur oxides (SO        2, SO 3...).    
    Fire Hazards
    Not available.
    Explosion Hazards
    Risks of explosion of the product in presence of mechanical impact: Not available.
    Risks of explosion of the product in presence of static discharge: Not available.
    Fire Fighting Media
    SMALL FIRE: Use DRY chemical powder.
    and Instructions
    LARGE FIRE: Use water spray, fog or foam. DO NOT use water jet.
    Consult with local fire authorities before attempting large scale fire-fighting operations.
    Continued on Next Page
    Chemi        trans-1,2-Di(2-thienyl)ethylene    
Section VI.        Accidental Release Measures    
    Spill Cleanup
    U se a shovel to put the m aterial into a convenient w aste disposal container. Finish cleaning the spill by rinsing any
    Instructions        contam inated surfaces w ith copious am ounts of w ater. C onsult federal, state, and/or local authorities for assistance on    
    disposal.
Section VII.        Handling and Storage    
    Handling and Storage
    K eep aw ay from heat. M echanical exhaust required. W hen not in use, tightly seal the container and store in a dry, cool
    place. Avoid excessive heat and light. Do not breathe dust.
    Information
    Always store away from incompatible compounds such as oxidizing agents.
Section VIII.        Exposure Controls/Personal Protection    
    Engineering Controls
    U se process enclosures, local exhaust ventilation, or other engineering controls to keep airborne levels below
    recom m ended exposure lim its. If user operations generate dust, fum e or m ist, use ventilation to keep exposure to
    airborne contaminants below the exposure limit.
    Personal Protection
    Splash goggles. Lab coat. D ust respirator. Boots. G loves. Suggested protective clothing m ight not be sufficient;
    consult a specialist BEFORE handling this product. Be sure to use a MSHA/NIOSH approved respirator or equivalent.
    Exposure Limits
    Not available.
Section IX.        Physical and Chemical Properties    
    Physical state @ 20°C        Solubility    
    Solid. (Powder.)
    Not available.
    Specific Gravity        Not available.    
    Molecular Weight        Partition Coefficient    
    192.3        Not available.    
    Boiling Point        Vapor Pressure    
    Not available.        Not applicable.    
    Melting Point        Vapor Density    
    133°C (271.4°F)        Not available.    
    Refractive Index        Volatility    
    Not available.        Not available.    
    Critical Temperature        Odor    
    Not available.        Not available.    
    Viscosity        Taste    
    Not available.        Not available.    
Section X.        Stability and Reactivity Data    
    Stability
This material is stable if stored under proper conditions. (See Section VII for instructions)
    Conditions of Instability
    Avoid excessive heat and light.
    Incompatibilities
    Reactive with oxidizing agents.
Section XI.        Toxicological Information    
    RTECS Number
    Not available.
    Routes of Exposure
    Eye Contact. Ingestion. inhalation.
    Toxicity Data
    Not available.
    Chronic Toxic Effects        CARCINOGENIC EFFECTS : Not available.    
    MUTAGENIC EFFECTS : Not available.
    TERATOGENIC EFFECTS : Not available.
    DEVELOPMENTAL TOXICITY : Not available.
    Repeated or prolonged exposure to this compound is not known to aggravate existing medical conditions.
    Acute Toxic Effects
    N o specific inform ation is available in our data base regarding the toxic effects of this m aterial for hum ans. H ow ever,
    exposure to any chem ical should be kept to a m inim u m . Skin and eye contact m ay result in irritation. M ay be harm ful if
    inhaled or ingested. A lw ays follow safe industrial hygiene practices and w ear proper protective equipm ent w hen
    handling this com pound. Follow safe industrial hygiene practices and alw ays w ear proper protective equipm ent w hen
    handling this compound.
    Continued on Next Page
    trans-1,2-Di(2-thienyl)ethylene
Section XII.        Ecological Information    
    Ecotoxicity
    Not available.
    Environmental Fate
    Not available.
Section XIII.        Disposal Considerations    
    Waste Disposal        Recycle to process, if possible. C onsult your local regional authorities. You m ay be able to dissove or m ix m aterial w ith a    
    com bustible solvent and burn in a chem ical incinerator equipped w ith an afterburner and scrubber system . O bserve all
    federal, state and locl regulations when disposing of the substance.
Section XIV.        Transport Information    
    DOT Classification
    Not a DOT controlled material (United States).
    PIN Number
    Not applicable.
    Proper Shipping Name
    Not applicable.
    Packing Group (PG)
    Not applicable.
    DOT Pictograms
Section XV.        Other Regulatory Information and Pictograms    
    TSCA Chemical Inventory
    T h is p r o d u c t is NOT o n t h e E P A T o x ic S u b s t a n c e s C o n t r o l A c t (T S C A ) in v e n t o r y . T h e f o llo w in g n o t ic e s a r e r e q u ir e d b y 4 0
    (EPA)        CFR 720.36 (C) for those products not on the inventory list:    
    (i) These products are supplied solely for use in research and developm ent by or under the supervision of a technically
    qualified individual as defined in 40 CFR 720.0 et sec.
    (ii) The health risks of these products have not been fully determ ined. A ny inform ation that is or becom es available w ill
    be supplied on an MSDS sheet.
    WHMIS Classification
    Not available.
    (Canada)
    EINECS Number (EEC)
    Not available.
    EEC Risk Statements
    Not available.
    Japanese Regulatory Data Not available.
Section XVI.
    Version 1.0
    Validated on 3/16/2001.

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%

分子结构与计算化学数据展开↓

分子结构数据

1、   摩尔折射率：60.41

2、   摩尔体积（m3/mol）：151.5

3、   等张比容（90.2K）：408.2

4、   表面张力（dyne/cm）：52.6

5、   极化率（10-24cm3）：23.95

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