13298-50-5 ((1,3-Butanedione,1-(2-naphthalenyl)-)

快速询单

结构式：

1,3-Butanedione,1-(2-naphthalenyl)-MOL文件

CAS号：

13298-50-5

英文名称：

1,3-Butanedione,1-(2-naphthalenyl)-

分子式：

C₁₄H₁₂O₂

分子量：

212.243884086609

1,3-Butanedione,1-(2-naphthalenyl)-(13298-50-5)名称与标识符

名称

英文别名：

1,3-Butanedione,1-(2-naphthalenyl)-;1-naphthalen-2-ylbutane-1,3-dione;1-(2-naphthyl)butane-1,3-dione;AC1L63JP;AC1Q5CEG;CTK4B8278;MolPort-002-548-359;NSC44993;STOCK1S-52645;SureCN2774094;NSC-44993;SR-01000028922;SCHEMBL2774094;DTXSID30286350;beta-naphthoylacetone;1-(naphthalen-2-yl)butane-1,3-dione;AKOS001013536;Z56788807;1-Methyl-3-(2-naphthyl)propane-1,3-dione;13298-50-5;SR-01000028922-1;NSC 44993;

标识符

InChIKey：

NFJOLQJZODADPL-UHFFFAOYSA-N

Inchi：

1S/C14H12O2/c1-10(15)8-14(16)13-7-6-11-4-2-3-5-12(11)9-13/h2-7,9H,8H2,1H3

SMILES：

O=C(CC(C)=O)C1C=CC2C=CC=CC=2C=1

1,3-Butanedione,1-(2-naphthalenyl)-(13298-50-5)物化性质

实验特性

LogP : 3.00160
PSA : 34.14000
折射率 : 1.6
沸点 : 369.7°Cat760mmHg
闪点 : 138.7°C
密度 : 1.145

计算特性

精确分子量 : 212.08400
氢键供体数量 : 0
氢键受体数量 : 2
可旋转化学键数量 : 3
同位素质量 : 212.084
重原子数量 : 16
复杂度 : 283
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） : 2.7
拓扑分子极性表面积 : 34.1Å²

1,3-Butanedione,1-(2-naphthalenyl)-(13298-50-5)海关数据

海关编码：

2914399090

海关数据：

中国海关编码：

2914399090

概述：

2914399090. 其他不含其他含氧基的芳香酮. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:5.5%. 普通关税:30.0%

申报要素：

品名, 成分含量, 用途, 丙酮报明包装

Summary：

2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

1,3-Butanedione,1-(2-naphthalenyl)-(13298-50-5)相关文献

1. Slow magnetic relaxation and luminescence properties in neodymium(iii)-4,4,4-trifluoro-1-(2-naphthyl)butane-1,3-dionato complexes incorporating bipyridyl ligands
Ramon Vicente,ànnia Tubau,Saskia Speed,Franz A. Mautner,Florian Bierbaumer,Roland C. Fischer,Salah S. Massoud New J. Chem. 2021 45 14713
2. Dysprosium(iii) complexes with a square-antiprism configuration featuring mononuclear single-molecule magnetic behaviours based on different β-diketonate ligands and auxiliary ligands
Sheng Zhang,Hongshan Ke,Quan Shi,Jangwei Zhang,Qi Yang,Qing Wei,Gang Xie,Wenyuan Wang,Desuo Yang,Sanping Chen Dalton Trans. 2016 45 5310
3. Slow magnetic relaxation of a mononuclear dysprosium complex derived from 4,4,4-trifluoro-1-(2-naphthyl)-1,3-butanedione and 1,10-phenanthroline
Shan-Shan Liu,Qi-Ming Guo,Bin Liu,Teng-Hui Jin,Zi-Hao Zhang,Shijing Lin,Yin-Shan Meng New J. Chem. 2023 47 2324
4. Tandem carbon–carbon bond insertion and intramolecular aldol reaction of benzyne with aroylacetones: novel formation of 4,4′-disubstituted 1,1′-binaphthols
Kentaro Okuma,Ryoichi Itoyama,Ayumi Sou,Noriyoshi Nagahora,Kosei Shioj Chem. Commun. 2012 48 11145
5. Regulating the single-molecule magnetic properties of phenol oxygen-bridged binuclear lanthanide complexes through the electronic and spatial effect of the substituents
Xiang-Wen Liu,Zhuo Wu,Ji-Tun Chen,Li Li,Peng Chen,Wen-Bin Sun Inorg. Chem. Front. 2020 7 1229
6. Structure and NIR-luminescence of ytterbium(iii) beta-diketonate complexes with 5-nitro-1,10-phenanthroline ancillary ligand: assessment of chain length and fluorination impact
Pablo Martín-Ramos,Pedro S. Pereira da Silva,Victor Lavín,Inocencio R. Martín,Fernando Lahoz,Pedro Chamorro-Posada,Manuela Ramos Silva,Jesús Martín-Gil Dalton Trans. 2013 42 13516
7. Hybrid materials based on lanthanide organic complexes: a review
Jing Feng,Hongjie Zhang Chem. Soc. Rev. 2013 42 387
8. Regulating the magnetic dynamics of mononuclear β-diketone Dy(iii) single-molecule magnets through the substitution effect on capping N-donor coligands
Jing Xi,Xiufang Ma,Peipei Cen,Yuewei Wu,Yi-Quan Zhang,Yan Guo,Jinhui Yang,Lei Chen,Xiangyu Liu Dalton Trans. 2021 50 2102
9. Switching of easy-axis to easy-plane anisotropy in cobalt(ii) complexes
Yuewei Wu,Jing Xi,Tongtong Xiao,Jesús Ferrando-Soria,Zhongwen Ouyang,Zhenxing Wang,Shuchang Luo,Xiangyu Liu,Emilio Pardo Inorg. Chem. Front. 2021 8 5158

3375-38-0(1,4-二苯甲酰丁烷) 495-71-6(1,2-联苯甲酰乙烷) 583-05-1(1-苯基-1,4-戊二酮) 58446-52-9(聚氯乙烯热稳定剂β二酮) 942-92-7(正己酰苯) 1083-30-3(β-苯基苯丙酮) 79622-11-0(七乙二醇单对甲苯磺酸酯) 79637-05-1(1-乙烯基-3-苄基-1H-咪唑鎓氯化物均聚物)

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