2-Bromo-1-(thiophen-3-yl)ethanone 2-溴-1-(噻吩-3-基)乙酮

CAS 1468-82-2 MFCD02677695

化学结构图

1468-82-2
SMILES: O=C(CBr)c1ccsc1

化学属性

Mol. FormulaC6H5BrOS
Mol. Weight205.07
Melting Point58-63 °C
Density
Boiling Point247.5±15.0 °C at 760 mmHg

别名和识别编码

Chemical Name2-Bromo-1-(thiophen-3-yl)ethanone
CAS Number1468-82-2
Alfabeta NameBROMOTHIENYLETHANONE 2131()------
MDL NumberMFCD02677695
Synonym 2-Bromo-1-(thiophen-3-yl)ethanone {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Bromo-1-(thiophen-3-yl)ethanone {}
Chemical Name Translation2-溴-1-(噻吩-3-基)乙酮
PubChem Substance ID2776379
EC Number
Beilstein Registry Number
LabNetwork Molecule IDLN00129484
InChIInChI=1S/C6H5BrOS/c7-3-6(8)5-1-2-9-4-5/h1-2,4H,3H2
Canonical SMILESBrCC(C1=CSC=C1)=O
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分类

  • {KO} ReacBromides
  • {KO} Ketones
  • {SNA} Building Blocks, C4 to C6, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Thiophenes

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Precautionary statements
  • P305 IF IN EYES: 如果进入眼睛
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
Signal word Warning
Safety Statements
  • 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；
Hazard Codes C,Xi Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R34 Causes burns 会导致灼伤
  • R36 Irritating to eyes 刺激眼睛
UN Number 3261
RTECS
Packing Group
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 3
Y
Lipinski's Rule of 5
Y
H-bond Acceptors
1
Rotatable Bonds
2
H-bond Donors
0
LogP
1

其他信息

  • MOL 文件:1468-82-2.mol
  • 水飞蓟宾 B价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 CC13105DE 水飞蓟宾 B 2-bromo-1-(3-thienyl)-1-ethanone 5 GR 6330元 2010/06/21 CC13105DA 水飞蓟宾 B 2-bromo-1-(3-thienyl)-1-ethanone 1 GR 1470元 2010/06/21 CC13105CB 水飞蓟宾 B 2-bromo-1-(3-thienyl)-1-ethanone 250 MG 1005元
  • Hazard Note:Corrosive
  • Acros Organics:2-bromo-1-(3-thienyl)-1-ethanone(1468-82-2)

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. Thiophenes 噻吩
  5. C4 to C6 - Thiophenes

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