Cas no 2433-20-7 (4-Isoxazolecarboxamide,N,N-diethyl-3,5-dimethyl-)
2433-20-7 structure
Product Name:4-Isoxazolecarboxamide,N,N-diethyl-3,5-dimethyl-
CAS No:2433-20-7
MF:C10H16N2O2
MW:196.246242523193
CID:266128
PubChem ID:17084
Update Time:2025-04-19
4-Isoxazolecarboxamide,N,N-diethyl-3,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Isoxazolecarboxamide,N,N-diethyl-3,5-dimethyl-
- N,N-diethyl-3,5-dimethyl-1,2-oxazole-4-carboxamide
- Oxalept
- 2433-20-7
- DTXSID80179066
- AKOS006243263
- CYCLITON
-
- Inchi： 1S/C10H16N2O2/c1-5-12(6-2)10(13)9-7(3)11-14-8(9)4/h5-6H2,1-4H3
- InChI Key： NFALFEDRJGVKNY-UHFFFAOYSA-N
- SMILES： O1C(C)=C(C(C)=N1)C(N(CC)CC)=O
Computed Properties
- Exact Mass: 196.12128
- Monoisotopic Mass: 196.121177757g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 204
- 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: 1.4
- Topological Polar Surface Area: 46.3?2
Experimental Properties
- PSA: 46.34
4-Isoxazolecarboxamide,N,N-diethyl-3,5-dimethyl- Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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3. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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