1-[(Aminooxy)methyl]-4-methylbenzene hydrochloride

CAS 38936-62-8 MFCD01114570

化学结构图

38936-62-8
SMILES: Cl.CC1=CC=C(CON)C=C1

化学属性

Mol. FormulaC8H12ClNO
Mol. Weight173.64
Melting Point220-230°

别名和识别编码

Chemical Name1-[(ammoniooxy)methyl]-4-methylbenzene chloride
CAS Number38936-62-8
Alfabeta NameAMINOOXYMETHYLMETHYLBENZENEHYDROCHLORIDE 14[]()---
MDL NumberMFCD01114570
Synonym 1-[(ammoniooxy)methyl]-4-methylbenzene chloride O-(p-Methylbenzyl)hydroxylamine hydrochloride
Wiswesser Line NotationZO1R D1 &GH
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分类

  • {KO} Hydroxylamines
  • {SNA} Amines, Building Blocks, C8, Chemical Synthesis, Ethers, Nitrogen Compounds, Organic Building Blocks, Oxygen Compounds

相关文献及参考

安全信息

Warnings IRRITANT
RTECSNC3950000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 200 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 7,329,1964

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

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
2
H-bond Donors
1
LogP
2

系列性分类

  1. C8 - Amines
  1. Functional Group 官能团索引
  2. hydroxylamine

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