1-(2-Bromoethoxy)-2,4-Dichlorobenzene 1-(2-溴乙氧基)-2,4-二氯苯

CAS 6954-77-4 MFCD00043464

化学结构图

6954-77-4
SMILES: Clc1ccc(OCCBr)c(Cl)c1

化学属性

Mol. FormulaC8H7BrCl2O
Mol. Weight269.95
Boiling Point175-179 °C at 10 mmHg
Melting PointBP: 120 - 130 @ 0.4mm Hg
TSCANo

别名和识别编码

Chemical Name1-(2-Bromoethoxy)-2,4-Dichlorobenzene
CAS Number6954-77-4
Alfabeta NameBROMOETHOXYDICHLOROBENZENE 1224()----,
MDL NumberMFCD00043464
Chemical Name Translation1-(2-溴乙氧基)-2,4-二氯苯
InChIKeyOEYZGSRLAGSENP-UHFFFAOYSA-N
LabNetwork Molecule IDLN00147863
PubChem Substance ID138881
InChIInChI=1S/C8H7BrCl2O/c9-3-4-12-8-2-1-6(10)5-7(8)11/h1-2,5H,3-4H2
Synonym 1-(2-Bromoethoxy)-2,4-dichlorobenzene {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-2,4-dichlorobenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(2-Bromoethoxy)-
Canonical SMILESC1=CC(=C(C=C1Cl)Cl)OCCBr
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分类

  • {KO} ReacBromides

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 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Packing GroupIII
UN Number UN2810
Risk Statements
  • R20/22 Harmful by inhalation and if swallowed 吸入和不慎吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Storage condition

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
1
Rotatable Bonds
3
H-bond Donors
0
LogP
3

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Halogenated Hydrocarbons 卤代烃
  5. Aryl 芳基卤代烃

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