2-(4-Nitrophenoxy)Benzenecarboxylic Acid 2-(4-硝基苯氧基)苯羧酸

CAS 6082-87-7 MFCD01002507

化学结构图

6082-87-7
SMILES: O=C(O)c1ccccc1Oc1ccc([N+](=O)[O-])cc1

化学属性

Mol. FormulaC13H9NO5
Mol. Weight259.21
Melting Point154-157 °C

别名和识别编码

Chemical Name2-(4-Nitrophenoxy)Benzenecarboxylic Acid
CAS Number6082-87-7
Alfabeta NameNITROPHENOXYBENZENECARBOXYLICACID 24()--
MDL NumberMFCD01002507
Chemical Name Translation2-(4-硝基苯氧基)苯羧酸
LabNetwork Molecule IDLN00147683
PubChem Substance ID458969
InChIInChI=1S/C13H9NO5/c15-13(16)11-3-1-2-4-12(11)19-10-7-5-9(6-8-10)14(17)18/h1-8H,(H,15,16)
Synonym 2-(4-Nitrophenoxy)benzoic acid {LY} 2-(4-Nitrophenoxy)benzoic acid {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Nitrophenoxy)benzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(4-Nitrophe
Canonical SMILESC1=CC=C(C(=C1)C(=O)O)OC2=CC=C(C=C2)[N+](=O)[O-]
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分类

  • {KO} Nitros
  • {KO} CarboxylicAcids

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
5
Rotatable Bonds
3
H-bond Donors
1
LogP
3

系列性分类

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