Cas no 920274-94-8 (1H-1,4,7-Triazonine-1,4,7-tripropanamide, hexahydro-)
920274-94-8 structure
Product Name:1H-1,4,7-Triazonine-1,4,7-tripropanamide, hexahydro-
CAS No:920274-94-8
MF:C15H30N6O3
MW:342.437102794647
CID:747745
PubChem ID:71422763
Update Time:2025-04-19
1H-1,4,7-Triazonine-1,4,7-tripropanamide, hexahydro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-1,4,7-Triazonine-1,4,7-tripropanamide, hexahydro-
- 3-[4,7-bis(3-amino-3-oxopropyl)-1,4,7-triazonan-1-yl]propanamide
- 920274-94-8
- 3,3',3''-(1,4,7-Triazonane-1,4,7-triyl)tripropanamide
- DTXSID90841767
-
- Inchi： 1S/C15H30N6O3/c16-13(22)1-4-19-7-9-20(5-2-14(17)23)11-12-21(10-8-19)6-3-15(18)24/h1-12H2,(H2,16,22)(H2,17,23)(H2,18,24)
- InChI Key： DUKAUGCDIFEMRH-UHFFFAOYSA-N
- SMILES： O=C(CCN1CCN(CCC(N)=O)CCN(CCC(N)=O)CC1)N
Computed Properties
- Exact Mass: 342.23793884g/mol
- Monoisotopic Mass: 342.23793884g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 24
- Rotatable Bond Count: 9
- Complexity: 358
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -3.3
- Topological Polar Surface Area: 139?2
1H-1,4,7-Triazonine-1,4,7-tripropanamide, hexahydro- Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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