960化工网

热搜：

Lactoyl-CoA 全氟丁基戊烷白叶藤碱全氟己基辛烷新白叶藤碱壳寡糖特色专题-生物多肽

329-94-2 (1,2-二氮杂双环[2.2.2]辛烷,1,2-Diazabicyclo[2.2.2]octane)

结构式：

1,2-二氮杂双环[2.2.2]辛烷结构式图片|329-94-2结构式图片

1,2-二氮杂双环[2.2.2]辛烷MOL文件

CAS号：

329-94-2

中文名称：

1,2-二氮杂双环[2.2.2]辛烷

英文名称：

1,2-Diazabicyclo[2.2.2]octane

分子式：

C₆H₁₂N₂

分子量：

112.172881126404

1,2-二氮杂双环[2.2.2]辛烷(329-94-2)名称与标识符

名称

中文别名：

1,2-二氮杂双环[2.2.2]辛烷;

英文别名：

1,2-Diazabicyclo[2.2.2]octane;1,2-Diazabicyclo(2.2.2)octane;SCHEMBL115270;4-diazabicyclo[2.2.2]octane;diazabicyclo-[2,2,2]-octane;diazabicyclo[2,2,2]octane;diazabicyclo [2.2.2]octane;329-94-2;DTXSID40186554;diazabicyclo (2.2.2) octane;1,2-diaza-bicyclo[2.2.2]octane;1,7-diazabicyclo[2.2.2]octane;diazabicyclo[2.2.2]-octane;AKOS015901957;diazabicyclo [2.2.2] octane;QVCUKHQDEZNNOC-UHFFFAOYSA-N;DB-291009;diazabicyclo(2.2.2)octane;Diazabicyclo[2.2.2]octane;

标识符

InChIKey：

QVCUKHQDEZNNOC-UHFFFAOYSA-N

Inchi：

1S/C6H12N2/c1-3-8-4-2-6(1)5-7-8/h6-7H,1-5H2

SMILES：

N12CCC(CN1)CC2

1,2-二氮杂双环[2.2.2]辛烷(329-94-2)物化性质

实验特性

PSA : 15.27

计算特性

精确分子量 : 112.10016
氢键供体数量 : 1
氢键受体数量 : 2
可旋转化学键数量 : 0
同位素质量 : 112.100048391g/mol
重原子数量 : 8
复杂度 : 84.5
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） : 0.5
拓扑分子极性表面积 : 15.3Å²

1,2-二氮杂双环[2.2.2]辛烷(329-94-2)相关文献

1. Bistable N–H?N hydrogen bonds for reversibly modulating the dynamic motion in an organic co-crystal
Chengmin Ji,Shenhui Li,Feng Deng,Sijie Liu,Muhammad Adnan Asghar,Zhihua Sun,Maochun Hong,Junhua Luo Phys. Chem. Chem. Phys. 2016 18 10868
2. Stereoselective synthesis of conformationally restricted KOR agonists based on the 2,5-diazabicyclo[2.2.2]octane scaffold
Christian Wittig,Dirk Schepmann,Michael Soeberdt,Constantin G. Daniliuc,Bernhard Wünsch Org. Biomol. Chem. 2017 15 6520
3. Binary complexes of tertiary amines with phenylacetylene. Dispersion wins over electrostatics
Surajit Maity,G. Naresh Patwari,S. Karthikeyan,Kwang S. Kim Phys. Chem. Chem. Phys. 2010 12 6150
4. Difunctional ammonium ionic liquids with bicyclic cations
Anna Turgu?a,Katarzyna Materna,Daniela Gwiazdowska,Filip Walkiewicz,Katarzyna Marcinkowska,Juliusz Pernak New J. Chem. 2019 43 4477
5. A facile synthesis of two new IR optical perovskites based on 1,4-diazabicyclo[2,2,2]octane with a high laser damage threshold
Jun-Ling Song,Wen-Jun Chen,Kai-Bin Chu,Yu-Hua Zhou Dalton Trans. 2018 47 14497
6. Synthesis, characterization and disorder–order phase transition of inorganic–organic hybrid materials (H2dabco-CH2-Cl)[MIICl4] (M = Co, Zn)
Chun-Hong Chen,Guan-Cheng Xu CrystEngComm 2016 18 550
7. Synthesis, characterization and disorder–order phase transition of inorganic–organic hybrid materials (H2dabco-CH2-Cl)[MIICl4] (M = Co, Zn)
Chun-Hong Chen,Guan-Cheng Xu CrystEngComm 2016 18 550
8. Bicyclic ammonium ionic liquids as dense hypergolic fuels
Yutao Yuan,Yanqiang Zhang,Long Liu,Nianming Jiao,Kun Dong,Suojiang Zhang RSC Adv. 2017 7 21592
9. Ring-opening reactions of 1,4-diazabicyclo[2.2.2]octane (DABCO) derived quaternary ammonium salts with phenols and related nucleophiles
Nenad Mara?,Slovenko Polanc,Marijan Ko?evar Org. Biomol. Chem. 2012 10 1300
10. Ring-opening reactions of 1,4-diazabicyclo[2.2.2]octane (DABCO) derived quaternary ammonium salts with phenols and related nucleophiles
Nenad Mara?,Slovenko Polanc,Marijan Ko?evar Org. Biomol. Chem. 2012 10 1300

目录

相关化合物

60678-83-3(十二氢吡啶并[1,2-b]邻苯二甲嗪) 80064-67-1((ASN5)-DELTA-SLEEP INDUCING PEPTIDE) 80110-35-6(methyl 3-aminoadamantane-1-carboxylate;hydrochloride) 8021-99-6(活性炭) 80259-15-0(2-(4-硝基苯基)乙烷磺酰氯) 80452-55-7(7-氯-2,3,4,5-四氢-1H-1-苯并氮杂-2,5-二酮) 8046-97-7(马钱子提取物) 80489-67-4((1Z,5E,8Z,10E,12R)-5,9-Dimethyl-12-isopropyl-1,5,8,10-cyclotetradecatetrene-1-carboxylic acid)

问答

960化工网为您提供1,2-二氮杂双环[2.2.2]辛烷专业化合物百科信息，包括中文名，英文名，分子式，分子量，以及该化合物的CasNo.329-94-2,相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等。 WAP版:329-94-2 国际站:329-94-2

© 2008-2025 南京九六零网络科技有限公司版权所有营业执照公示

粤ICP备2021105330号-3 公安机关备案号32010502010001 苏公网安备32011202001462号法律声明