2-(4-Methoxybenzoyl)benzoic acid 2-(4-甲氧基苯甲酰基)苯甲酸

CAS 1151-15-1 MFCD00278217

化学结构图

1151-15-1
SMILES: COc1ccc(C(=O)c2ccccc2C(=O)O)cc1

化学属性

Mol. FormulaC15H12O4
Mol. Weight256.25
Melting Point147-148 °C
Boiling Point359.49 °C at 760 mmHg

别名和识别编码

Chemical Name2-(4-Methoxybenzoyl)benzoic acid
CAS Number1151-15-1
Alfabeta NameMETHOXYBENZOYLBENZENECARBOXYLICACID 24()--
MDL NumberMFCD00278217
Chemical Name Translation2-(4-甲氧基苯甲酰基)苯甲酸
Synonym 2-(4-Methoxybenzoyl)benzoic acid {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Methoxybenzoyl)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
LabNetwork Molecule IDLN00117822
PubChem Substance ID231963
InChIInChI=1S/C15H12O4/c1-19-11-8-6-10(7-9-11)14(16)12-4-2-3-5-13(12)15(17)18/h2-9H,1H3,(H,17,18)
Canonical SMILESCOC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O
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分类

  • {KO} CarboxylicAcids

安全信息

Warnings IRRITANT
Hazard Codes Xi
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Acceptors
4
Rotatable Bonds
4
H-bond Donors
1
LogP
2

其他信息

  • Hazard Note:Irritant
  • MOL 文件:1151-15-1.mol

系列性分类

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