4-(4-Chlorophenyl)-1H-pyrazol-5-amine

CAS 40545-65-1 MFCD00231866

化学结构图

40545-65-1
SMILES: NC1NN=CC=1C1C=CC(Cl)=CC=1

化学属性

Mol. FormulaC9H8ClN3
Mol. Weight193.63
Melting Point63 - 65 (°C)

别名和识别编码

Chemical Name4-(4-chlorophenyl)-1H-pyrazol-5-amine
CAS Number40545-65-1
Alfabeta NameCHLOROPHENYLPYRAZOLAMINE H4415()------
MDL NumberMFCD00231866
Synonym 3-Amino-4(p-chlorophenyl)-pyrazole 4-(4-chlorophenyl)-1H-pyrazol-5-amine USAF EL-83
Wiswesser Line NotationT5MNJ CZ DR DG
Beilstein Registry Number0641017
PubChem Substance ID329790582
Chemical Name Translation
信息真实价格透明    资金保障    专业采购外包团队在线服务   
信息真实价格透明    资金保障    专业采购外包团队在线服务   
品牌质保精细包装    现货库存    一流品牌服务   

分类

  • {KO} AminesSecondaryHeteroNH
  • {SNA} Building Blocks, C3-C9, C9, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Pyrazoles
  • {KO} AminesPrimary

安全信息

Warnings IRRITANT
RTECSUQ5250000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD277-689

GHS Symbol
WGK Germany3
Signal word Warning
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
Hazard statements
  • H302 Harmful if swallowed 吞食有害

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
2
H-bond Acceptors
1
Rotatable Bonds
1
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. Pyrazoles 吡唑
  5. C9 - Pyrazoles

相关产品推荐