2-Amino-4-phenylthiazole 2-氨基-4-苯基噻唑

CAS 2010-06-2 MFCD00039680

化学结构图

2010-06-2
SMILES: Nc1nc(-c2ccccc2)cs1

化学属性

Mol. FormulaC9H8N2S
Mol. Weight176.24
Melting Point149-153°C
TSCANo
Density1.261
Boiling Point363.4±11.0 °C at 760 mmHg
Flash Point173.6±19.3 °C

别名和识别编码

Chemical Name2-Amino-4-phenylthiazole
CAS Number2010-06-2
Alfabeta NamePHENYLTHIAZOLAMINE 4132-----,
MDL NumberMFCD00039680
Synonym 4-Phenylthiazol-2-amine {LY} 4-Phenylthiazol-2-amine {} {LY} 4-Phenylthiazol-2-amine {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Phenylthiazol-2-amine {} {} {} {} {} {} {} {} {} {} {} {} {} {
EC Number217-926-8
Beilstein Registry Number128609
PubChem Substance ID253661329
Chemical Name Translation2-氨基-4-苯基噻唑
Wiswesser Line NotationT5N CSJ BZ ER
Reaxys-RN128609
InChIInChI=1S/C9H8N2S/c10-9-11-8(6-12-9)7-4-2-1-3-5-7/h1-6H,(H2,10,11)
LabNetwork Molecule IDLN00007931
Canonical SMILESNC1=NC(C2=CC=CC=C2)=CS1
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分类

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

安全信息

Warnings IRRITANT
RTECSXJ2878000
Safety Statements
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
  • 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;
  • 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;
Packing GroupIII
UN Number 2811 UN2811
Risk Statements
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
  • R25 Toxic if swallowed 吞咽有毒
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。
  • 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+P310
  • P301+P310+P330
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • 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
  • 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
Signal word Danger
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Hazard Codes T Xn,Xi
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 140 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

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 320 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#00815

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
2

其他信息

  • Sigma Aldrich:2010-06-2(sigmaaldrich)
  • MOL 文件:2010-06-2.mol
  • MSDS 信息:4-Phenylthiazol-2-amine(2010-06-2).msds
  • 2-氨基-4-苯基噻唑价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 A18488 2-氨基-4-苯基噻唑, 98% 2-Amino-4-phenylthiazole, 98% 5g 2226元 2010/05/25 A18488 2-氨基-4-苯基噻唑, 98% 2-Amino-4-phenylthiazole, 98% 1g 580元
  • Alfa Aesar:2-氨基-4-苯基噻唑,98% 2-Amino-4-phenylthiazole, 98%(2010-06-2)
  • 图谱信息:2-氨基-4-苯基噻唑(2010-06-2)红外图谱(IR2) 2-氨基-4-苯基噻唑(2010-06-2)红外图谱(IR1) 2-氨基-4-苯基噻唑(2010-06-2)质谱(MS)

系列性分类


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