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19836-78-3 | 2-Oxazolidinone, 3-methyl-
CAS No: 19836-78-3 Catalog No: AG002BHD MDL No:MFCD00009759
Product Description
Catalog Number:
AG002BHD
Chemical Name:
2-Oxazolidinone, 3-methyl-
CAS Number:
19836-78-3
Molecular Formula:
C4H7NO2
Molecular Weight:
101.1039
MDL Number:
MFCD00009759
IUPAC Name:
3-methyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C4H7NO2/c1-5-2-3-7-4(5)6/h2-3H2,1H3
InChI Key:
VWIIJDNADIEEDB-UHFFFAOYSA-N
SMILES:
O=C1OCCN1C
EC Number:
243-361-1
Properties
Complexity:
91.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
101.048g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
101.105g/mol
Monoisotopic Mass:
101.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| A cylindrical core-shell-like TiO2 nanotube array anode for flexible fiber-type dye-sensitized solar cells. | Nanoscale research letters 20110101 |
| Ammonium hydrogen (RS)-[(5-methyl-2-oxo-1,3-oxazolidin-3-yl)meth-yl]phospho-nate. | Acta crystallographica. Section E, Structure reports online 20100101 |
| Design of HIV-1 protease inhibitors with pyrrolidinones and oxazolidinones as novel P1'-ligands to enhance backbone-binding interactions with protease: synthesis, biological evaluation, and protein-ligand X-ray studies. | Journal of medicinal chemistry 20090709 |
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