2,4-Dichloro-5,6,7,8-tetrahydroquinazoline 2,4-二氯-5,6,7,8-四氢喹唑啉

CAS 1127-85-1 MFCD09750204

化学结构图

1127-85-1
SMILES: Clc1nc(Cl)c2c(n1)CCCC2

化学属性

Mol. FormulaC8H8Cl2N2
Mol. Weight203.07
Melting Point72-73 °C
Boiling Point325.6±42.0 °C at 760 mmHg

别名和识别编码

Chemical Name2,4-Dichloro-5,6,7,8-tetrahydroquinazoline
CAS Number1127-85-1
Alfabeta NameDICHLOROCYCLOPENTAPYRIMIDINE HHHD24567[]---,,,
MDL NumberMFCD12400774
Synonym 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {} {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {} {} {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {} {} {} {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,4-Dichloro-5,6,7,8-tetrahydroqui
Chemical Name Translation2,4-二氯-5,6,7,8-四氢喹唑啉
PubChem Substance ID12602864
InChIInChI=1S/C8H8Cl2N2/c9-7-5-3-1-2-4-6(5)11-8(10)12-7/h1-4H2
Canonical SMILESClC1=C2CCCCC2=NC(Cl)=N1
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分类

  • {KO} ReacChlorides
  • {SNA} Building Blocks, C6 to C8, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, New Products for Chemical Synthesis, Pyrimidines

安全信息

Warnings IRRITANT
Hazard Codes Xn
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；
GHS Symbol
WGK Germany3
Precautionary statements
  • P305+P351+P338
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
Signal word Warning
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • R22 Harmful if swallowed 吞咽有害
Storage condition -20°C, sealed storage, away from moisture {LY} -20°C, sealed storage, away from moisture {} {LY} -20°C, sealed storage, away from moisture {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, awa

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
2
Rotatable Bonds
0
H-bond Donors
0
LogP
2

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. Pyrimidines 嘧啶
  5. C6 to C8 - Pyrimidines

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