3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid 3-(乙氧基羰基)-4,4-二苯基丁-3-烯酸

CAS 5438-22-2 MFCD00215361

化学结构图

5438-22-2
SMILES: CCOC(=O)C(CC(=O)O)=C(c1ccccc1)c1ccccc1

化学属性

Mol. FormulaC19H18O4
Mol. Weight310.34
Melting Point128-130 °C

别名和识别编码

Chemical Name3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid
CAS Number5438-22-2
Alfabeta NameETHOXYCARBONYLDIPHENYLBUTENOICACID 3443()-----,
MDL NumberMFCD00215361
Chemical Name Translation3-(乙氧基羰基)-4,4-二苯基丁-3-烯酸
LabNetwork Molecule IDLN00147891
PubChem Substance ID226295
InChIInChI=1S/C19H18O4/c1-2-23-19(22)16(13-17(20)21)18(14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3,(H,20,21)
Synonym 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {} {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {} {} {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {} {} {} {} {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphenylbut-3-enoic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-(Ethoxycarbonyl)-4,4-diphen
Canonical SMILESCCOC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)CC(=O)O
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分类

  • {KO} CarboxylicAcids
  • {KO} Esters

安全信息

Warnings IRRITANT
Storage condition

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
4
Rotatable Bonds
8
H-bond Donors
1
LogP
3

系列性分类

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