2-(Chloromethyl)Benzothiazole 2-(氯甲基)苯并噻唑

CAS 37859-43-1 MFCD05664944

化学结构图

37859-43-1
SMILES: ClCC1=NC2=CC=CC=C2S1

化学属性

Mol. FormulaC8H6ClNS
Mol. Weight183.65
Boiling Point90°C/0.3mmHg(lit.)
Melting PointBP: 102 @ 0 mBar
Density

别名和识别编码

Chemical Name2-(Chloromethyl)Benzothiazole
CAS Number37859-43-1
Alfabeta NameCHLOROMETHYLBENZOTHIAZOLE 213()---,
MDL NumberMFCD05664944
Beilstein Registry Number120805
Synonym 2-(Chloromethyl)benzothiazole
EC Number
Chemical Name Translation2-(氯甲基)苯并噻唑
PubChem Substance ID354335665
Reaxys-RN120805
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分类

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

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
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。
  • P272 Contaminated work clothing should not be allowed out of the workplace. 污染的工作服不得带出工作场所。
  • 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 IF SWALLOWED: 如果吞下去
  • P301+P312+P330
  • P302
  • P302+P352+P333+P313+P362+P364
  • P305 IF IN EYES: 如果进入眼睛
  • P305+P351+P338+P310
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • 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
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 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置；
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
UN Number
RTECS
Packing Group
Storage condition 0-10°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
1
H-bond Donors
0
LogP
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. Thiazoles 噻唑
  5. C8 to C9 - Thiazoles

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