4-Chloro-7-azaindole 4-氯-7-氮杂吲哚

CAS 55052-28-3 MFCD08272232

化学结构图

55052-28-3
SMILES: Clc1ccnc2[nH]ccc12

化学属性

Mol. FormulaC7H5ClN2
Mol. Weight152.58
Melting Point174-176°C
Density1.422
TSCANo

别名和识别编码

Chemical Name4-Chloro-7-azaindole
CAS Number55052-28-3
Alfabeta NameCHLOROPYRROLOPYRIDINE HB4123[]----,
MDL NumberMFCD08272232
Synonym 4-Chloro-7-azaindole {LY} 4-Chloro-7-azaindole {} {LY} 4-Chloro-7-azaindole {} {} {LY} 4-Chloro-7-azaindole {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-7-azaindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
EC Number250-023-7
Beilstein Registry Number907680
Chemical Name Translation4-氯-7-氮杂吲哚
Reaxys-RN907680
PubChem Substance ID160870961
LabNetwork Molecule IDLN00008968
Canonical SMILESClC1=C2C(NC=C2)=NC=C1
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分类

  • {KO} ReacChlorides
  • Azaindoles, Building Blocks, C7 to C9, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Indoles
  • {KO} AminesSecondaryHeteroNH
  • {SNA} Azaindoles, Building Blocks, C7 to C9, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Indoles

产品应用

  • A useful intermediate for drug discovery research.

相关文献及参考

  • Caldwell, J., et al.: Tet. Lett., 48, 1527 (2007)

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。
  • 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
  • P305+P351+P338
  • P332+P313
  • 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
Signal word Danger
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
  • H301 Toxic if swallowed 吞食有毒
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, 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;
  • S36/37/39 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;
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置;
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
  • 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
Storage condition 2-8°C {LY} 2-8°C Store at room temperature {} {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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°
UN Number 2811
Hazard Codes 6.1 Xn
Packing GroupIII

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
2

系列性分类


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