2-Acetyl-5-chlorothiophene 2-乙酰基-5-氯噻酚

CAS 6310-09-4 MFCD00005444

化学结构图

6310-09-4
SMILES: CC(=O)c1ccc(Cl)s1

化学属性

Mol. FormulaC6H5ClOS
Mol. Weight161
Boiling Point117-118
Melting Point46-49
Density1.422
Flash Point108°(226°F)
TSCANo

别名和识别编码

Chemical Name2-Acetyl-5-chlorothiophene
CAS Number6310-09-4
Alfabeta NameACETYLCHLOROTHIOPHENE 25---
MDL NumberMFCD00005444
Synonym 2-Acetyl-5-chlorothiophene ,99% ba11044 2-Chloro-5-acetylthiophene 5-CHLORO-2-THIENYL METHYL KETONE Ethanone,1-(5-chloro-2-thienyl)- 1-(5-Chloro-2-thienyl)ethanone ketone,5-chloro-2-thienylmethyl 2-乙酰-5-氯噻吩 5-chlor-2-acetylthiophen 5-CHLORO-2-ACETYLTHIOPHENE 5-氯-2-噻吩基甲基酮 1-(5-Chloro-thiophen-2-yl)-ethanone 2-乙醯-5-氯噻吩 2-乙酰基-5-氯噻酚 2-Acetyl-5-chlorothiophene 2-乙酰基-5-氯噻吩 5-Chlor-2-acetyl thiophen BA 11044
EC Number228-630-3
Beilstein Registry Number113936
PubChem Substance ID80572
Reaxys-RN113936
Chemical Name Translation2-乙酰基-5-氯噻酚
Wiswesser Line NotationT5SJ BV1 EG
LabNetwork Molecule IDLN00115557
InChIKeyHTZGPEHWQCRXGZ-UHFFFAOYSA-N
InChIInChI=1S/C6H5ClOS/c1-4(8)5-2-3-6(7)9-5/h2-3H,1H3
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分类

  • {uni_hamburg} no charge; sulfur heterocycle; aromatic; 5ring; ketone; 1fragment
  • {SNA} Building Blocks, C4 to C6, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Thiophenes

相关文献及参考

  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

Warnings IRRITANT
Signal word
GHS Symbol
WGK Germany3
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • 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；
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
Risk Statements
Precautionary statements
RTECSOB1745000
Packing GroupIII
UN Number
Storage condition Light Sensitive
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Hazard Class6.1
Hazard Codes 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 500 mg/kg
SEX/DURATION            : male 20 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - testes, epididymis, sperm duct
REFERENCE :
   ANREAK Anatomical Record.  (Alan R. Liss, Inc., 41 E. 11th St., New York, NY
   10003)  V.1-    1906/08-  Volume(issue)/page/year: 125,312,1956

其他信息

  • TCI Shanghai:2-乙酰基-5-氯噻吩 2-Acetyl-5-chlorothiophene,>;99.0%(GC)(6310-09-4)
  • 可燃性危险特性:遇热, 明火, 氧化剂燃烧; 热分解排出有毒硫氧化物, 氯化物烟雾
  • Alfa Aesar:2-乙酰基-5-氯噻吩,99% 2-Acetyl-5-chlorothiophene, 99%(6310-09-4)
  • Sigma Aldrich:6310-09-4(sigmaaldrich)
  • 类别:易燃液体
  • 检测方法:HPLC
  • 上游原料:三氯化铝 --> 乙酰氯 --> 2-氯噻吩
  • Acros Organics:2-乙酰-5-氯噻吩 2-Acetyl-5-chlorothiophene, 99%(6310-09-4)
  • MOL 文件:6310-09-4.mol
  • 储运特性:库房低温通风干燥; 防明火, 高温, 与氧化剂分开存放
  • 灭火剂:二氧化碳, 泡沫, 干粉
  • 2-乙酰基-5-氯噻酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 A1471 2-乙酰基-5-氯噻吩 2-Acetyl-5-chlorothiophene 5G 370元 2014/06/02 A1471 2-乙酰基-5-氯噻吩 2-Acetyl-5-chlorothiophene 25G 1110元 2010/06/21 306700250 2-乙酰基-5-氯噻酚 2-Acetyl-5-chlorothiophene 99% 25 GR 1275元
  • 敏感性:Light Sensitive

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Thiazolines/Thiazolidines 噻唑啉/噻唑烷
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Thiophenes 噻吩
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Halogenated Heterocycles 卤代杂环
  5. Thiophenes - Halogenated Heterocycles
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Thiophenes 噻吩
  5. C4 to C6 - Thiophenes
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Halogenated Heterocycles 卤代杂环
  5. Thiazolines/Thiazolidines