3-Bromothiophene-2-carboxaldehyde 3-溴噻吩-2-甲醛

CAS 930-96-1 MFCD00126680

化学结构图

930-96-1
SMILES: O=Cc1sccc1Br

化学属性

Mol. FormulaC5H3BrOS
Mol. Weight191.05
Boiling Point250.3°C at 760 mmHg
Density1.755
Melting Point25°C
Refractive index1.6360 to 1.6400
TSCANo
Flash Point110-113°C/10mm
Stability对空气敏感

别名和识别编码

Chemical Name3-Bromothiophene-2-carboxaldehyde, 97%
CAS Number930-96-1
Alfabeta NameBROMOTHIOPHENECARBALDEHYDE 32---
MDL NumberMFCD00126680
EC Number000-000-0
Beilstein Registry Number109757
Synonym 3-Bromothiophene-2-carboxaldehyde {LY} 3-Bromothiophene-2-carboxaldehyde {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} { {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Bromothiophene-2-carboxal
Reaxys-RN109757
PubChem Substance ID2797079
Chemical Name Translation3-溴噻吩-2-甲醛
LabNetwork Molecule IDLN00146488
InChIInChI=1S/C5H3BrOS/c6-4-1-2-8-5(4)3-7/h1-3H
Canonical SMILESBrC(C=CS1)=C1C=O
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分类

  • {KO} Aldehydes
  • {KO} ReacBromides
  • {SNA} Aldehydes, Building Blocks, C1 to C6, C4 to C6, Carbonyl Compounds, Chemical Synthesis, Heterocyclic Building Blocks, Organic Building Blocks, Thiophenes

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • 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；
  • S37 Wear suitable gloves 戴适当手套；
Risk Statements
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Precautionary statements
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • 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。
  • P264+P265
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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。
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P304+P340
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Storage condition -20°C, protect from light, stored under nitrogen {LY} -20°C, protect from light, stored under nitrogen 0-10 0-10°C Air Sensitive Refrigerator {} {LY} -20°C, protect from light, stored under nitrogen {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, protect from light, stored under nitrog
Hazard Codes Xn Xi Xi,Xn
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激

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
1
H-bond Donors
0
LogP
1

其他信息

  • 上游原料:乙醚 --> 四氢呋喃 --> N,N-二甲基甲酰胺 --> 正丁基锂 --> 氮 --> 二异丙基氨基锂 --> 3-溴噻吩 --> 2,3-二溴噻吩
  • TCI Shanghai:3-溴噻吩-2-甲醛 3-Bromothiophene-2-carboxaldehyde,>;95.0%(GC)(930-96-1)
  • 敏感性:Air Sensitive
  • 图谱信息:3-溴噻吩-2-甲醛(930-96-1)核磁图( 1 HNMR)
  • Acros Organics:3-溴噻吩-2-甲醛 3-Bromothiophene-2-carbaldehyde, 95%(930-96-1)
  • Alfa Aesar:3-溴噻吩-2-羰醛,94% 3-Bromothiophene-2-carboxaldehyde, 94%(930-96-1)
  • Hazard Note:Irritant
  • MOL 文件:930-96-1.mol
  • 存储注意事项:惰性气体保护
  • 3-溴噻吩-2-甲醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B2934 3-溴噻吩-2-甲醛 3-Bromothiophene-2-carboxaldehyde 25G 6000元 2014/06/02 B2934 3-溴噻吩-2-甲醛 3-Bromothiophene-2-carboxaldehyde 1G 623元 2014/06/02 B2934 3-溴噻吩-2-甲醛 3-Bromothiophene-2-carboxaldehyde 5G 2010元

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
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Alphabetic - Analytical Standards
  4. B - Alphabetic
  5. BA - BH - B
  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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