260-36-6 (苯并[g]喹啉,Benzo[g]quinoline)

快速询单

结构式：

苯并[g]喹啉MOL文件

CAS号：

260-36-6

中文名称：

苯并[g]喹啉

英文名称：

Benzo[g]quinoline

分子式：

C₁₃H₉N

分子量：

179.217262983322

苯并[g]喹啉(260-36-6)名称与标识符

名称

英文别名：

Benzo[g]quinoline;1-Azaanthracene;6,7-Benzoquinoline;Naphthazine;Naphtho-2',3':2,3-pyridine;MFCD00220360;SCHEMBL50867;NS00014395;Q63399231;SY264644;DTXSID60891496;260-36-6;EU-0000059;RFQDDXWZZVRLKO-UHFFFAOYSA-N;AKOS006371430;

标识符

MDL：

MFCD00220360

InChIKey：

RFQDDXWZZVRLKO-UHFFFAOYSA-N

Inchi：

1S/C13H9N/c1-2-5-11-9-13-12(6-3-7-14-13)8-10(11)4-1/h1-9H

SMILES：

N1C=CC=C2C=C3C=CC=CC3=CC=12

苯并[g]喹啉(260-36-6)物化性质

实验特性

PSA : 12.89
折射率 : 1.7270 (estimate)
沸点 : 301.75°C (rough estimate)
熔点 : 114°C
密度 : 1.1255 (rough estimate)

计算特性

精确分子量 : 179.07357
氢键供体数量 : 0
氢键受体数量 : 1
可旋转化学键数量 : 0
同位素质量 : 179.073499
重原子数量 : 14
复杂度 : 201
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 3.5
拓扑分子极性表面积 : 12.9

苯并[g]喹啉(260-36-6)相关文献

1. Efficient near-infrared-emitting cationic iridium complexes based on highly conjugated cyclometalated benzo[g]phthalazine derivatives
Lijun Xin,Jie Xue,Gangtie Lei,Juan Qiao RSC Adv. 2015 5 42354
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5. Metallation of pyridines and quinolines in the presence of a remote carboxylate group. New syntheses of heterocyclic quinones
Anne-Sophie Rebstock,Florence Mongin,Fran?ois Trécourt,Guy Quéguiner Org. Biomol. Chem. 2004 2 291
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7. High-efficiency orange to near-infrared emissions from bis-cyclometalated iridium complexes with phenyl-benzoquinoline isomers as ligands
Juan Qiao,Lian Duan,Lingtian Tang,Lei He,Liduo Wang,Yong Qiu J. Mater. Chem. 2009 19 6573
8. Recent advances in versatile pyridazine-cored materials: principles, applications, and challenges
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9. Cyclobutarenes. Part 2. Azaquinomethanes as reactive intermediates: synthesis of cyclobuta[b]pyridine and cyclobuta[b]pyrazine derivatives
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10. High-efficiency near-infrared organic light-emitting devices based on an iridium complex with negligible efficiency roll-off
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