577-95-7 (1,2-蒽二醇,1,2-Anthracenediol)

快速询单

结构式：

1,2-蒽二醇MOL文件

CAS号：

577-95-7

中文名称：

1,2-蒽二醇

英文名称：

1,2-Anthracenediol

分子式：

C₁₄H₁₀O₂

分子量：

210.228003978729

1,2-蒽二醇(577-95-7)名称与标识符

名称

英文别名：

anthracene-1,2-diol;577-95-7;DTXSID90973294;Q27149391;CHEBI:80376;Anthracenediol;1,2-Anthradiol;SCHEMBL82870;70143-54-3;1,2-Anthracenediol;dihydroxyanthracene;1,2-dihydroxyanthracene;

标识符

InChIKey：

UTCOUOISVRSLSH-UHFFFAOYSA-N

Inchi：

1S/C14H10O2/c15-13-6-5-11-7-9-3-1-2-4-10(9)8-12(11)14(13)16/h1-8,15-16H

SMILES：

OC1C(O)=C2C(C=C3C(=C2)C=CC=C3)=CC=1

1,2-蒽二醇(577-95-7)物化性质

计算特性

精确分子量 : 210.068079557Da
氢键供体数量 : 2
氢键受体数量 : 2
可旋转化学键数量 : 0
同位素质量 : 210.068079557Da
重原子数量 : 16
复杂度 : 253
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） : 3.7
拓扑分子极性表面积 : 40.5Å²

1,2-蒽二醇(577-95-7)相关文献

1. A novel fluorescent covalent organic framework containing boric acid groups for selective capture and sensing of cis-diol molecules
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3. LXXXIII.—Aromatic thionyl and chlorothionyl derivaties. Part II. 1 : 2- and 2 : 3-Thionyldihydroxyanthracenes
Albert Green J. Chem. Soc. 1927 554
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5. CCXXIV.—Reduction products of the hydroxyanthraquinones. Part II
John Hall,Arthur George Perkin J. Chem. Soc. Trans. 1923 123 2029
6. A large-scale synthesis of the bioreductive drug 1,4-bis{[2-(dimethylamino)ethyl]amino}-5,8-dihydroxyanthracene-9,10-dione bis-N-oxide (AQ4N)
Ho H. Lee,William A. Denny J. Chem. Soc. Perkin Trans. 1 1999 2755
7. Quinones. Part 14. Attempted synthesis of 9,10-dimethyl-2,6-anthraquinone. Desmotropic formation of secondary ortho-anthraquinoles instead of 1,2-anthrahydroquinones
Peter Boldt,Stephan Zippel,Michael Ratzkowsky J. Chem. Soc. Perkin Trans. 1 1996 2615
8. The reduction of anthraquinone and other polycyclic quinones with aluminium alkoxides (Meerwein–Pondorff reagent)
Samuel Coffey,V. Boyd J. Chem. Soc. 1954 2468
9. Tuning photoinduced processes of covalently bound isoalloxazine and anthraquinone bichromophores
Angeles Farrán,John Mohanraj,Guy J. Clarkson,Rosa M. Claramunt,Fernando Herranz,Gianluca Accorsi Photochem. Photobiol. Sci. 2013 12 813
10. Water-assisted self-photoredox of 2-(1-hydroxyethyl)-9,10-anthraquinone through a triplet excited state intra-molecular proton transfer pathway
Jingze Dai,Juan Han,Xuebo Chen,Weihai Fang,Jiani Ma,David Lee Phillips Phys. Chem. Chem. Phys. 2015 17 27001

577-95-7 (1,2-蒽二醇,1,2-Anthracenediol)

1,2-蒽二醇(577-95-7)名称与标识符

名称

标识符

1,2-蒽二醇(577-95-7)物化性质

计算特性

1,2-蒽二醇(577-95-7)相关文献

目录