1214-20-6 (2-甲氧基-9-占顿酮,9H-Xanthen-9-one,2-methoxy-)

快速询单

结构式：

2-甲氧基-9-占顿酮MOL文件

CAS号：

1214-20-6

中文名称：

2-甲氧基-9-占顿酮

英文名称：

9H-Xanthen-9-one,2-methoxy-

分子式：

C₁₄H₁₀O₃

分子量：

226.227404117584

2-甲氧基-9-占顿酮(1214-20-6)名称与标识符

名称

中文别名：

2-甲氧基-9-占顿酮;

英文别名：

9H-Xanthen-9-one,2-methoxy-;2-METHOXYXANTHEN-9-ONE;2-Methoxy-9H-xanthen-9-one;2-methoxyl-9H-xanthen-9-one;2-Methoxy-xanthen-9-on;2-methoxy-xanthen-9-one;2-methoxyxanthone;4-methoxyxanthone;9H-Xanthen-9-one,2-methoxy;KUC102603N;SPBio_000410;BRD-K02855712-001-02-5;2-Methoxy-9H-xanthen-9-one #;HMS2203P05;1214-20-6;CCG-40234;CHEBI:169168;MLS001143195;KBioSS_000560;BDBM50155417;Spectrum_000120;3-(8-chloroquinoline-4-yl)acrylicacid;Spectrum3_001321;KBio3_002261;HMS3356B16;Spectrum4_001601;DTXSID10153258;MLS000859019;2-methoxyxanthen-9-one, AldrichCPR;SCHEMBL394209;Xanthen-9-one, 2-methoxy-;BSPBio_003041;7-methoxyxanthone;MFCD01312686;KBioGR_001941;BRD-K02855712-001-06-6;CHEMBL186609;KBio2_000560;KBio2_003128;KBio2_005696;Spectrum2_000425;NS00097991;InChI=1/C14H10O3/c1-16-9-6-7-13-11(8-9)14(15)10-4-2-3-5-12(10)17-13/h2-8H,1H;SMR000459198;Spectrum5_000321;9H-Xanthen-9-one, 2-methoxy-;NCGC00178333-01;

标识符

MDL：

MFCD01312686

InChIKey：

DVZCOQQFPCMIPO-UHFFFAOYSA-N

Inchi：

1S/C14H10O3/c1-16-9-6-7-13-11(8-9)14(15)10-4-2-3-5-12(10)17-13/h2-8H,1H3

SMILES：

O1C2C=CC=CC=2C(C2C=C(C=CC1=2)OC)=O

2-甲氧基-9-占顿酮(1214-20-6)物化性质

实验特性

LogP : 2.95480
PSA : 39.44000

计算特性

精确分子量 : 226.06300
氢键供体数量 : 0
氢键受体数量 : 3
可旋转化学键数量 : 1
同位素质量 : 226.062994177g/mol
重原子数量 : 17
复杂度 : 302
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） : 3.6
拓扑分子极性表面积 : 35.5Å²

2-甲氧基-9-占顿酮(1214-20-6)安全信息

危险品标志： Xn
危险类别码： 22

2-甲氧基-9-占顿酮(1214-20-6)海关数据

海关编码：

2932999099

海关数据：

中国海关编码：

2932999099

概述：

2932999099. 其他仅含氧杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

申报要素：

品名, 成分含量, 用途

Summary：

2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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6. Studies in the xanthone series. Part XII. A general synthesis of polyoxygenated xanthones from benzophenone precursors
Augustus J. Quillinan,Feodor Scheinmann J. Chem. Soc. Perkin Trans. 1 1973 1329
7. Chemical investigation of ceylonese plants. Part XVII. Isolation and structures of the xanthones in the extractives of Mesua ferrea L. (form M. salicina Pl. and Tr.)(Guttiferae)
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A. M. Choudhury,K. Schofield,R. S. Ward J. Chem. Soc. C 1970 2543
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10. Preparative uses of aryldiazonium salts of complex fluoro-acids. Part II. Novel preparations of fluorenones and xanthones from aryldiazonium tetrafluoroborates
C. F. Sellers,H. Suschitzky J. Chem. Soc. C 1969 2139