5-Bromo-6-chloronicotinic acid 5-溴-6-氯烟酸

CAS 29241-62-1 MFCD01927098

化学结构图

29241-62-1
SMILES: OC(=O)C1C=C(Br)C(Cl)=NC=1

化学属性

Mol. FormulaC6H3BrClNO2
Mol. Weight236
Melting Point166-168°
TSCANo
Density1.422
pH:A

别名和识别编码

Chemical Name5-Bromo-6-chloronicotinic acid
CAS Number29241-62-1
Alfabeta NameBROMOCHLORONICOTINICACID 56---
MDL NumberMFCD01927098
Synonym 5-Bromo-6-chloropyridine-3-carboxylic acid 5-bromo-6-chloronicotinic acid
EC Number250-023-7
Beilstein Registry Number2384789
Chemical Name Translation5-溴-6-氯烟酸
PubChem Substance ID253660675
Reaxys-RN472863
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分类

  • {SA} Building Blocks, C6 to C7, Chemical Synthesis, Heterocyclic Building Blocks, New Products for Chemical Synthesis, Pyridines
  • {KO} ReacChlorides
  • {KO} ReacBromides
  • {KO} CarboxylicAcids
  • {SNA} Building Blocks, C6, Chemical Synthesis, Heterocyclic Building Blocks, Pyridines

安全信息

Warnings IRRITANT
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；
  • S36/37/38
  • 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；
  • S37 Wear suitable gloves 戴适当手套；
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Signal word Warning
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
Storage condition 储存温度2-8℃
Hazard Codes Xn
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H315 Causes skin irritation 会刺激皮肤

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
3
Rotatable Bonds
1
H-bond Donors
1
LogP
2

系列性分类

  1. C6 - Pyridines
  1. C6 to C7 - Pyridines

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