4-(4-Chlorophenyl)-1,3-thiazol-2-amine 2-氨基-4-(4-氯苯基)噻唑

CAS 2103-99-3 MFCD00047058

化学结构图

2103-99-3
SMILES: Nc1nc(-c2ccc(Cl)cc2)cs1

化学属性

Mol. FormulaC9H7ClN2S
Mol. Weight210.68
Melting Point169-171°C
TSCANo
Boiling Point389.8°C at 760 mmHg

别名和识别编码

Chemical Name2-Amino-4-(4-chlorophenyl)thiazole
CAS Number2103-99-3
Alfabeta NameCHLOROPHENYLTHIAZOLAMINE 44132()------,
MDL NumberMFCD00047058
Synonym 4-(4-chlorophenyl)thiazol-2-amine {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {PubChem} 2-amino-4-(4-chlorophenyl)thiazole {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-(4-chlorophenyl)thiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {}
Beilstein Registry Number153889
PubChem Substance ID73241
Chemical Name Translation2-氨基-4-(4-氯苯基)噻唑
InChIKeyDWGWNNCHJPKZNC-UHFFFAOYSA-N
Reaxys-RN153889
LabNetwork Molecule IDLN00131242
InChIInChI=1S/C9H7ClN2S/c10-7-3-1-6(2-4-7)8-5-13-9(11)12-8/h1-5H,(H2,11,12)
Canonical SMILESClC1=CC=C(C2=CSC(N)=N2)C=C1
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分类

  • {SNA} Building Blocks, C8 to C9, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Thiazoles
  • {KO} AminesPrimary

安全信息

Warnings IRRITANT
RTECSXJ1026732
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 Wear suitable protective clothing 穿戴适当的防护服；
Risk Statements
  • 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
WGK Germany3
GHS Symbol
Precautionary statements
  • 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
  • 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。
  • 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。
  • P301+P310
  • P301+P310+P330
  • P301+P316
  • 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）。
  • P330 Rinse mouth. 漱口
  • 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.....
Hazard statements
  • H301 Toxic if swallowed 吞食有毒
  • 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
Signal word Danger Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Hazard Codes 6.1
UN Number 2811 UN 2811 6.1/PG 3
Packing GroupIII 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 300 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EPXXDW European Patent Application. (U.S. Patent and Trademark Office,
   Foreign Patents, Washington, DC 20231)  Volume(issue)/page/year: #0001727

Hazard Class6.1
Storage condition 2-8°C, protect from light {LY} 2-8°C, protect from light {} {LY} 2-8°C, protect from light {} {} {LY} 2-8°C, protect from light {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

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
1
LogP
3

其他信息

  • Hazard Note:Irritant
  • MOL 文件:2103-99-3.mol
  • Alfa Aesar:2-氨基-4-(4-氯苯基)噻唑,98% 2-Amino-4-(4-chlorophenyl)thiazole, 98%(2103-99-3)
  • 5-甲酰基噻唑-2-氨基甲酸叔丁酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 L14067 2-氨基-4-(4-氯苯基)噻唑, 98% 2-Amino-4-(4-chlorophenyl)thiazole, 98% 5g 1004元 2010/05/25 L14067 2-氨基-4-(4-氯苯基)噻唑, 98% 2-Amino-4-(4-chlorophenyl)thiazole, 98% 1g 255元
  • Sigma Aldrich:2103-99-3(sigmaaldrich)

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. Thiazoles 噻唑
  5. C8 to C9 - Thiazoles
  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. Thiazoles - Halogenated Heterocycles

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