2-Oxazolidinone - CAS 497-25-6
Catalog: |
BB026811 |
Product Name: |
2-Oxazolidinone |
CAS: |
497-25-6 |
Synonyms: |
1,3-oxazolidin-2-one |
IUPAC Name: | 1,3-oxazolidin-2-one |
Description: | 2-Oxazolidinone (CAS# 497-25-6) is also used in the preparation of compounds with antitumor activity. A metabolite of Furazolidone (F864100). |
Molecular Weight: | 87.08 |
Molecular Formula: | C3H5NO2 |
Canonical SMILES: | C1COC(=O)N1 |
InChI: | InChI=1S/C3H5NO2/c5-3-4-1-2-6-3/h1-2H2,(H,4,5) |
InChI Key: | IZXIZTKNFFYFOF-UHFFFAOYSA-N |
Boiling Point: | 220 °C (48 mmHg) |
Melting Point: | 86-89 °C |
Purity: | 98 % |
Density: | 1.204 g/cm3 |
Solubility: | >13.1 [ug/mL] (The mean of the results at pH 7.4) |
Appearance: | Yellow-beige crystalline powder. |
Storage: | Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00005268 |
LogP: | 0.05500 |
GHS Hazard Statement: | H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]; H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P333+P313, P337+P317, P362+P364, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113480435-A | Method for aminolysis of tar residues and recovery of organic resources | 20210806 |
CN-113480714-A | Epoxy resin modified polyurethane reinforcing material and preparation method thereof | 20210729 |
CN-113248471-A | Preparation method of zolamide drug intermediate and intermediate thereof | 20210705 |
CN-113248471-B | Preparation method of zolamide drug intermediate and intermediate thereof | 20210705 |
CN-113354620-A | Efficient preparation method of tedizolid intermediate and intermediate thereof | 20210705 |
PMID | Publication Date | Title | Journal |
34375108 | 20210923 | Invention of MK-8262, a Cholesteryl Ester Transfer Protein (CETP) Inhibitor Backup to Anacetrapib with Best-in-Class Properties | Journal of medicinal chemistry |
34498872 | 20210923 | Toward a Best-in-Class Inhibitor of Cholesteryl Ester Transfer Protein (CETP) | Journal of medicinal chemistry |
33913699 | 20210517 | Nonclinical Evaluation of Antibacterial Oxazolidinones Contezolid and Contezolid Acefosamil with Low Serotonergic Neurotoxicity | Chemical research in toxicology |
31675166 | 20200107 | Synthesis and Structure-Activity Relationships of N-(4-Benzamidino)-Oxazolidinones: Potent and Selective Inhibitors of Kallikrein-Related Peptidase 6 | ChemMedChem |
31129132 | 20190801 | Zolmitriptan attenuates hepatocellular carcinoma via activation of caspase mediated apoptosis | Chemico-biological interactions |
Complexity: | 71.2 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 87.03202840200001 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 87.03202840200001 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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Related Functional Groups
Oxazole/Thiazole
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