Cas no 906728-33-4 (4-Oxazolecarboxylicacid, 4,5-dihydro-2-methyl-5-oxo-)
906728-33-4 structure
Product Name:4-Oxazolecarboxylicacid, 4,5-dihydro-2-methyl-5-oxo-
CAS No:906728-33-4
MF:C5H5NO4
MW:143.097501516342
CID:797833
PubChem ID:291590
Update Time:2025-04-19
4-Oxazolecarboxylicacid, 4,5-dihydro-2-methyl-5-oxo- Chemical and Physical Properties
Names and Identifiers
-
- 4-Oxazolecarboxylicacid, 4,5-dihydro-2-methyl-5-oxo-
- 2-methyl-5-oxo-4H-1,3-oxazole-4-carboxylic acid
- 4-OXAZOLECARBOXYLIC ACID,4,5-DIHYDRO-2-METHYL-5-OXO-
- 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid
- DTXSID30303132
- NSC-156906
- 906728-33-4
- NSC156906
-
- Inchi： 1S/C5H5NO4/c1-2-6-3(4(7)8)5(9)10-2/h3H,1H3,(H,7,8)
- InChI Key： BVTRLVSCYJALOP-UHFFFAOYSA-N
- SMILES： O1C(C)=NC(C(=O)O)C1=O
Computed Properties
- Exact Mass: 143.022
- Monoisotopic Mass: 143.022
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 220
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.1
- Topological Polar Surface Area: 76?2
4-Oxazolecarboxylicacid, 4,5-dihydro-2-methyl-5-oxo- Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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