4,5-Dimethylthiazole 4,5-二甲基噻唑

CAS 3581-91-7 MFCD00005336

化学结构图

3581-91-7
SMILES: Cc1ncsc1C

化学属性

Mol. FormulaC5H7NS
Mol. Weight113.18
Boiling Point158.1°C at 760 mmHg
Density1.07
Refractive index1.5140 to 1.5230
Flash Point51°C
TSCANo
Melting Point83-84 °C

别名和识别编码

Chemical Name4,5-Dimethylthiazole
CAS Number3581-91-7
Alfabeta NameDIMETHYLTHIAZOLE 45-,
MDL NumberMFCD00005336
Synonym 4,5-Dimethylthiazole {LY} 4,5-Dimethylthiazole {} {LY} 4,5-Dimethylthiazole {} {} {LY} 4,5-Dimethylthiazole {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Dimethylthiazole {} {} {} {} {} {} {}
EC Number222-703-3
Beilstein Registry Number105694
PubChem Substance ID62510
Reaxys-RN105694
Chemical Name Translation4,5-二甲基噻唑
LabNetwork Molecule IDLN00008706
InChIInChI=1S/C5H7NS/c1-4-5(2)7-3-6-4/h3H,1-2H3
Canonical SMILESCC1=C(C)N=CS1
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分类

  • {uni_hamburg} no charge; sulfur heterocycle; nitrogen heterocycle; aromatic; 5ring; 1fragment
  • {SNA} Alphabetical Listings, C-D, Flavors and Fragrances
  • {SA} Building Blocks, C3 to C7, Chemical Synthesis, Heterocyclic Building Blocks, Thiazoles
  • {SNA} Alphabetical Listings, C-D, Certified Food Grade Products, Flavors and Fragrances

相关文献及参考

  • Short: II/27B Title: Diamagnetic Susceptibility of Organic Compounds, Oils, Paraffins and Polyethylenes Author: Kumar, M.; Gupta, R. Editor: Gupta, Radha Raman Source: Landolt-Börnstein, New Series Volume: II/27B Year: 2008 Keyword: diamagnetic susceptibility; organic compounds ISBN: 978-3-540-44359-9 (print) ISBN: 978-3-540-45860-9 (online) Internet Resource: doi:10.1007/978-3-540-45860-9 RefComment: VIII, 503 p. With CD-ROM., Hardcover RefComment: Written for: Scientists and researchers in the fields of physics, chemistry, materials science RefComment: Supplement and Revised Editon to II/16 Abstract: The volume II/27 has been divided into three subvolumes according to the classes of compounds: Subvolume A: Diamagnetic susceptibility and magnetic anisotropy of inorganic and organometallic compounds; Subvolume B: Diamagnetic susceptibility of organic compounds, oils, paraffins and polyethylenes; Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds. The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005. The calculated values of diamagnetic susceptibility of organic compounds in the present subvolume II/27B are presented along with their experimental values. They have been calculated with the use of structural parameters in structural formula by using different theoretical methods available in the literature.
  • Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids ISBN: 3-540-60596-7 ISBN: 978-3-540-60596-6 Internet Resource: DOI:10.1007/b85533 RefComment: VII, 4210 pages, Hardcover Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains th

安全信息

Warnings IRRITANT
Signal word Danger
GHS Symbol
WGK Germany3
Safety Statements
  • S16 Keep away from sources of ignition - No smoking 远离火源,禁止吸烟;
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护;
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置;
Risk Statements
  • R10 Flammable 易燃
  • R22 Harmful if swallowed 吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
Precautionary statements
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西,喝水或吸烟。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P301+P312
  • P301+P312+P330
  • P301+P317
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P337+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服,清洗后方可重新使用
  • P370+P378
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
RTECSXJ4380000
Packing GroupIII
UN Number 1993
Hazard Codes 3
Hazard Class3
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 960 mg/kg
TOXIC EFFECTS :
   Sense Organs and Special Senses (Eye) - chromodacryorrhea
   Lungs, Thorax, or Respiration - dyspnea
   Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
   ATDAEI Acute Toxicity Data. Journal of the American College of Toxicology,
   Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128)  V.1-
   1990-  Volume(issue)/page/year: 1,95,1990

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • Sigma Aldrich:3581-91-7(sigmaaldrich)
  • 图谱信息:4,5-二甲基噻唑(3581-91-7)核磁图( 1 HNMR) 4,5-二甲基噻唑(3581-91-7)红外图谱(IR1) 4,5-二甲基噻唑(3581-91-7)核磁图( 13 CNMR) 4,5-二甲基噻唑(3581-91-7)质谱(MS)
  • 用途一:用作食品添加剂
  • FEMA:3274
  • MOL 文件:3581-91-7.mol
  • 食品添加剂最大允许使用量最大允许残留量标准:添加剂中文名称 允许使用该种添加剂的食品中文名称 添加剂功能 最大允许使用量(g/kg) 最大允许残留量(g/kg) 4,5-二甲基噻唑 食品 食品用香料 用于配制香精的各香料成分不得超过在GB 2760中的最大允许使用量和最大允许残留量
  • Alfa Aesar:4,5-二甲基噻唑,98% 4,5-Dimethylthiazole, 98%(3581-91-7)
  • 4,5-二甲基噻唑价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D2142 4,5-二甲基噻唑 4,5-Dimethylthiazole 5G 280元 2014/06/02 D2142 4,5-二甲基噻唑 4,5-Dimethylthiazole 25G 917元 2010/05/25 A10785 4,5-二甲基噻唑, 98% 4,5-Dimethylthiazole, 98% 25g 1862元
  • MSDS 信息:4,5-Dimethylthiazole(3581-91-7).msds
  • 上游原料:甲酰胺
  • TCI Shanghai:4,5-二甲基噻唑 4,5-Dimethylthiazole,>;94.0%(GC)(3581-91-7)
  • 检测方法:GC,NMR

系列性分类