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4364-78-7 ((N,N'-diaminoguanidine)

结构式：

N,N'-diaminoguanidine结构式图片|4364-78-7结构式图片

N,N'-diaminoguanidineMOL文件

CAS号：

4364-78-7

英文名称：

N,N'-diaminoguanidine

分子式：

CH₇N₅

分子量：

89.0997784137726

相关分类：

溶剂及有机化学品 > 有机化合物 > Organic nitrogen compounds > Organonitrogen compounds > Hydrazines and derivatives > Hydrazidines

N,N'-diaminoguanidine(4364-78-7)名称与标识符

名称

英文别名：

Carbonimidicdihydrazide;1,1-diaminoguanidine;diaminoguanidine;1,3-Diaminoguanidine;Carbonimidic acid,dihydrazide;Guanidine, N,N'-diamino-;Guanidine,1,3-diamino- (6CI,7CI,8CI);Imidocarbonic aciddihydrazide;N,N'-Diaminoguanidine;36062-19-8 (Mono-hydrochloride);38360-74-6 (Hydrochloride);Carbonimidic dihydrazide;CH7N5;

标识符

InChIKey：

JGGFDEJXWLAQKR-UHFFFAOYSA-N

Inchi：

1S/CH7N5/c2-1(5-3)6-4/h3-4H2,(H3,2,5,6)

SMILES：

C(=N)(NN)NN

N,N'-diaminoguanidine(4364-78-7)物化性质

实验特性

PSA : 99.95
沸点 : 184.8±23.0 °C(Predicted)
酸度系数(pKa) : 8.28±0.70(Predicted)
密度 : 1.86±0.1 g/cm3(Predicted)

计算特性

精确分子量 : 89.07031
氢键供体数量 : 4
氢键受体数量 : 3
可旋转化学键数量 : 1
重原子数量 : 6
复杂度 : 55
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） : -2.3
互变异构体数量 : 无
表面电荷 : 0

N,N'-diaminoguanidine(4364-78-7)相关文献

1. Heterocyclic compounds from urea derivatives. Part IX. Addition products of diaminoguanidine and isothiocyanate esters, and their cyclisation
Frederick Kurzer,K. Douraghi-Zadeh J. Chem. Soc. C 1966 1
2. 6,8-(1,3-Diaminoguanidine) luteolin and its Cr complex show hypoglycemic activities and alter intestinal microbiota composition in type 2 diabetes mice
Xiaodong Ge,Xiaoyu He,Zhenshan Lin,Yuxian Zhu,Xiaoqin Jiang,Liyuan Zhao,Feng Zeng,Ligen Chen,Wei Xu,Tingting Liu,Zhigang Chen,Chao Zhao,Ying Huang,Bin Liu Food Funct. 2022 13 3572
3. 727. Heterocyclic compounds from urea derivatives. Part VII. Addition-products of diaminoguanidine and carbodi-imides, and their cyclisation
Frederick Kurzer,K. Douraghi-Zadeh J. Chem. Soc. 1965 3912
4. Heterocyclic compounds from urea derivatives. Part X. Addition products of isocyanate esters and diaminoguanidine or its hydrazones, and their cyclisation
Frederick Kurzer,K. Douraghi-Zadeh J. Chem. Soc. C 1966 6
5. Design, synthesis, molecular docking and biological evaluation of 1,2,4-triazole derivatives possessing a hydrazone moiety as anti-breast cancer agents
Michael Tapera,Hüseyin Keke?muhammed,Cansu Umran Tunc,Aybuke Ulku Kutlu,?smail ?elik,Yunus Zorlu,Omer Aydin,Emin Sar?p?nar New J. Chem. 2023 47 11602
6. Structural and anti-oxidant properties of guanidinium pyrazole-3,5-dicarboxylates
S. Packiaraj,A. Pushpaveni,S. Govindarajan,J. M. Rawson CrystEngComm 2016 18 7978
7. Trap passivation and efficiency improvement of perovskite solar cells by a guanidinium additive
Jiaxu Yao,Hui Wang,Pang Wang,Robert S. Gurney,Akarin Intaniwet,Pipat Ruankham,Supab Choopun,Dan Liu,Tao Wang Mater. Chem. Front. 2019 3 1357
8. Heterocyclic compounds from urea derivatives. Part XIX. Adducts from diaminoguanidines and aroyl isothiocyanates and their cyclisation
Frederick Kurzer J. Chem. Soc. C 1970 1813
9. Triazines and related products. Part X. A re-examination of the reaction between benzil and diaminoguanidine nitrate
M. F. G. Stevens J. Chem. Soc. Perkin Trans. 1 1972 1221
10. A thermally stable nitrogen-rich energetic material—3,4,5-triamino-1-tetrazolyl-1,2,4-triazole (TATT)
Guo-Hong Tao,Brendan Twamley,Jean'ne M. Shreeve J. Mater. Chem. 2009 19 5850

目录

相关化合物

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