Methyl 4'-nitro[1,1'-biphenyl]-4-carboxylate 4'-硝基-[1,1'-联苯]-4-羧酸甲酯

CAS 5730-75-6 MFCD04117797

化学结构图

5730-75-6
SMILES: COC(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1

化学属性

Mol. FormulaC14H11NO4
Mol. Weight257.24
Melting Point188-190 °C

别名和识别编码

Chemical NameMethyl 4'-nitro[1,1'-biphenyl]-4-carboxylate
CAS Number5730-75-6
Alfabeta NameMETHYLNITROBIPHENYLCARBOXYLATE 4114[]----,''
MDL NumberMFCD04117797
Synonym Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {} {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {} {} {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {} {} {} {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Methyl 4'-nitro-[1,1'-biphenyl]-4-carboxylate {} {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation4'-硝基-[1,1'-联苯]-4-羧酸甲酯
PubChem Substance ID2763696
InChIInChI=1S/C14H11NO4/c1-19-14(16)12-4-2-10(3-5-12)11-6-8-13(9-7-11)15(17)18/h2-9H,1H3
LabNetwork Molecule IDLN00147371
Canonical SMILESCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)[N+](=O)[O-]
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分类

  • {KO} Nitros
  • {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
3
H-bond Donors
0
LogP
3

系列性分类

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