Methyl 5-(4-methoxyphenyl)-5-oxopentanoate 5-(4-甲氧基苯基)-5-氧代戊酸甲酯

CAS 1847-68-3 MFCD00229176

化学结构图

1847-68-3
SMILES: COC(=O)CCCC(=O)c1ccc(OC)cc1

化学属性

Mol. FormulaC13H16O4
Mol. Weight236.26

别名和识别编码

Chemical NameMethyl 5-(4-methoxyphenyl)-5-oxopentanoate
CAS Number1847-68-3
Alfabeta NameMETHYLMETHOXYPHENYLOXOPENTANOATE 545()----
MDL NumberMFCD00229176
Chemical Name Translation5-(4-甲氧基苯基)-5-氧代戊酸甲酯
LabNetwork Molecule IDLN00156194
PubChem Substance ID3276138
InChIInChI=1S/C13H16O4/c1-16-11-8-6-10(7-9-11)12(14)4-3-5-13(15)17-2/h6-9H,3-5H2,1-2H3
Synonym Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {} {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {} {} {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxopentanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 5-(4-methoxyphenyl)-5-oxope
Canonical SMILESCOC1=CC=C(C=C1)C(=O)CCCC(=O)OC
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分类

  • {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
7
H-bond Donors
0
LogP
1

系列性分类

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