2-Hydroxy-1,3-oxazole-5-carboxylic acid - CAS 1407858-88-1
Catalog: |
BB060941 |
Product Name: |
2-Hydroxy-1,3-oxazole-5-carboxylic acid |
CAS: |
1407858-88-1 |
Synonyms: |
2-Hydroxy-1,3-oxazole-5-carboxylic acid; 2-oxo-3H-1,3-oxazole-5-carboxylic acid; 2,3-dihydro-2-oxo-5-Oxazolecarboxylic acid; 2-Hydroxy-1,3-oxazole-5-carboxylicacid |
IUPAC Name: | 2-oxo-3H-1,3-oxazole-5-carboxylic acid |
Description: | 2-Hydroxy-1,3-oxazole-5-carboxylic acid |
Molecular Weight: | 129.07 |
Molecular Formula: | C4H3NO4 |
Canonical SMILES: | C1=C(OC(=O)N1)C(=O)O |
InChI: | InChI=1S/C4H3NO4/c6-3(7)2-1-5-4(8)9-2/h1H,(H,5,8)(H,6,7) |
InChI Key: | JYNCBJSUVBTQPI-UHFFFAOYSA-N |
Melting Point: | >165°C (dec.) |
Solubility: | DMSO, Methanol (Slightly) |
Appearance: | Off-White to Dark Brown Solid |
Storage: | -20°C Freezer, Under inert atmosphere |
Complexity: | 195 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 129.00620758 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 129.00620758 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 75.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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