494-13-3 ((2-phenyl-4H-chromene)

快速询单

结构式：

2-phenyl-4H-chromeneMOL文件

CAS号：

494-13-3

英文名称：

2-phenyl-4H-chromene

分子式：

C₁₅H₁₂O

分子量：

208.255184173584

2-phenyl-4H-chromene(494-13-3)名称与标识符

名称

英文别名：

2-Phenyl-γ-chromene;2-phenyl-4H-chromene;2-phenyl-4H-chromen;494-13-3;2-phenyl-4h-1-benzopyran;DTXSID301312831;SCHEMBL667761;flaven;4H-1-Benzopyran, 2-phenyl-;OJXOWGJHAMWLIZ-UHFFFAOYSA-N;

标识符

InChIKey：

OJXOWGJHAMWLIZ-UHFFFAOYSA-N

Inchi：

1S/C15H12O/c1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15/h1-9,11H,10H2

SMILES：

O1C(C2C=CC=CC=2)=CCC2C=CC=CC1=2

2-phenyl-4H-chromene(494-13-3)物化性质

计算特性

精确分子量 : 208.088815002Da
氢键供体数量 : 0
氢键受体数量 : 1
可旋转化学键数量 : 1
同位素质量 : 208.088815002Da
重原子数量 : 16
复杂度 : 263
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） : 4
拓扑分子极性表面积 : 9.2Å²

2-phenyl-4H-chromene(494-13-3)相关文献

1. Single and double intramolecular proton transfers in the electronically excited state of flavone derivatives
I. E. Serdiuk,A. D. Roshal RSC Adv. 2015 5 102191
2. Lithiation in flavones, chromones, coumarins, and benzofuran derivatives
Ana M. B. S. R. C. S. Costa,Francis M. Dean,Michael A. Jones,Rajender S. Varma J. Chem. Soc. Perkin Trans. 1 1985 799
3. A new 2-phenyl-4H-1-benzopyran (flav-2-ene) synthesis
G. Casiraghi,G. Casnati,G. Salerno J. Chem. Soc. C 1971 2546
4. Cytotoxic effect, generation of reactive oxygen/nitrogen species and electrochemical properties of Cu(ii) complexes in comparison to half-sandwich complexes of Ru(ii) with aminochromone derivatives
Paulina Mucha,Pawel Hikisz,Krzysztof Gwo?dziński,Urszula Krajewska,Andrzej Leniart,Elzbieta Budzisz RSC Adv. 2019 9 31943
5. Kinetic and thermodynamic control in the lithiation of 2,6-dimethylchromone, and selective lithiations in 2-(x-furyl)chromones and in furanochromones related to khellin
Anna M. B. S. R. C. S. Costa,Francis M. Dean,Michael A. Jones,Dennis A. Smith J. Chem. Soc. Perkin Trans. 1 1986 1707
6. An efficient tandem synthesis of chromones from o-bromoaryl ynones and benzaldehyde oxime
Jing-Wen Zhang,Wan-Wan Yang,Lu-Lu Chen,Pei Chen,Yan-Bo Wang,Dan-Yun Chen Org. Biomol. Chem. 2019 17 7461
7. Analysis of ofloxacin and flavoxate HCl either individually or in combination via a green chromatographic approach with a pharmacokinetic study of ofloxacin in biological samples
Rania Nabih El-Shaheny,Nahed Mahmoud El-Enany,Fathalla Fathalla Belal Anal. Methods 2015 7 4629
8. A green HPLC method for the analysis and stability study of flavoxate HCl using micellar eluent
Rania Nabih El-Shaheny,Nahed Mahmoud El-Enany,Fathalla Fathalla Belal Anal. Methods 2014 6 1001
9. Rates of pyrolysis and bond energies of substituted organic iodides (Part I)
E. T. Butler,M. Polanyi Trans. Faraday Soc. 1943 39 19
10. Conformational studies. Part 10. Crystal and molecular structure of 17β-iodoacetoxy-4,4-dimethyl-5α-androst-7-en-3-one
George Ferguson,Roderic J. Restivo,Geoffrey A. Lane,John M. Midgley,W. Basil Whalley J. Chem. Soc. Perkin Trans. 2 1978 1038

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494-13-3 ((2-phenyl-4H-chromene)

2-phenyl-4H-chromene(494-13-3)名称与标识符

名称

标识符

2-phenyl-4H-chromene(494-13-3)物化性质

计算特性

2-phenyl-4H-chromene(494-13-3)相关文献

目录