Cas no 873962-83-5 (3,5-Isoxazoledicarboxamide)
3,5-Isoxazoledicarboxamide structure
Product Name:3,5-Isoxazoledicarboxamide
CAS No:873962-83-5
MF:C5H5N3O3
MW:155.111500501633
CID:709583
PubChem ID:45117983
Update Time:2025-04-19
3,5-Isoxazoledicarboxamide Chemical and Physical Properties
Names and Identifiers
-
- 3,5-Isoxazoledicarboxamide
- 1,2-oxazole-3,5-dicarboxamide
- DTXSID70668717
- 873962-83-5
- isoxazole-3,5-dicarboxamide
-
- Inchi： 1S/C5H5N3O3/c6-4(9)2-1-3(5(7)10)11-8-2/h1H,(H2,6,9)(H2,7,10)
- InChI Key： QXMFLVHGOUBIRP-UHFFFAOYSA-N
- SMILES： O1C(C(N)=O)=CC(C(N)=O)=N1
Computed Properties
- Exact Mass: 155.033
- Monoisotopic Mass: 155.033
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 193
- 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
- Topological Polar Surface Area: 112A^2
- XLogP3: -1.2
3,5-Isoxazoledicarboxamide Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
873962-83-5 (3,5-Isoxazoledicarboxamide) Related Products
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