3-Amino-2-oxazolidinone - CAS 80-65-9
Catalog: |
BB046771 |
Product Name: |
3-Amino-2-oxazolidinone |
CAS: |
80-65-9 |
Synonyms: |
3-Aminooxazolidin-2-one; 3-Amino-2-oxazolidone; 2-Oxazolidinone, 3-amino-; AOZ; NSC 111187; NSC 196570; NSC 38250 |
IUPAC Name: | 3-amino-1,3-oxazolidin-2-one |
Description: | A metabolite of Furazolidone and Nitrofuran. |
Molecular Weight: | 102.09 |
Molecular Formula: | C3H6N2O2 |
Canonical SMILES: | C1COC(=O)N1N |
InChI: | InChI=1S/C3H6N2O2/c4-5-1-2-7-3(5)6/h1-2,4H2 |
InChI Key: | KYCJNIUHWNJNCT-UHFFFAOYSA-N |
Boiling Point: | 167.2 ℃ at 760 mmHg |
Melting Point: | 59-62 ℃ |
Purity: | > 95 % |
Density: | 1.363 g/cm3 |
Solubility: | Soluble in Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
Appearance: | White to off-white solid |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 92.9 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 102.042927438 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 102.042927438 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 55.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.8 |
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