6-Bromo-1H-indazole 6-溴-1H-吲唑

CAS 79762-54-2 MFCD03265457

化学结构图

79762-54-2
SMILES: Brc1ccc2cn[nH]c2c1

化学属性

Mol. FormulaC7H5BrN2
Mol. Weight197.03
Melting Point180-185°C
TSCANo
Boiling Point333.8±15.0 °C at 760 mmHg

别名和识别编码

Chemical Name6-Bromo-1H-indazole
CAS Number79762-54-2
Alfabeta NameBROMOINDAZOLE H61---
MDL NumberMFCD03265457
Chemical Name Translation6-溴-1H-吲唑
Beilstein Registry Number172088965
Synonym 6-Bromo-1H-indazole {LY} 6-Bromo-1H-indazole {} {LY} 6-Bromo-1H-indazole {} {} {LY} 6-Bromo-1H-indazole {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 6-Bromo-1H-indazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID172088965
Reaxys-RN10424074
Canonical SMILESBrC1=CC2=C(C=C1)C=NN2
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分类

  • {KO} AminesSecondaryHeteroNH
  • {SNA} Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Indazoles
  • Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Indazoles

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
Signal word Danger
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
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；
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
Hazard Codes Xn
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

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 Donors
1
H-bond Acceptors
1
Rotatable Bonds
0
LogP
1

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. Halogenated Heterocycles 卤代杂环
  5. Indazoles - Halogenated Heterocycles

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