| CAS Number | 1177353-88-6 |
| Catalog Number | AG01ARBK(AGN-PC-0WCNZR) |
| Chemical Name | 5-(aminomethyl)-3-(3-methoxyphenyl)-1,3-oxazolidin-2-one hydrochloride |
| IUPAC Name | 5-(aminomethyl)-3-(3-methoxyphenyl)-1,3-oxazolidin-2-one;hydrochloride |
| InChI | InChI=1S/C11H14N2O3.ClH/c1-15-9-4-2-3-8(5-9)13-7-10(6-12)16-11(13)14;/h2-5,10H,6-7,12H2,1H3;1H |
| InChI Key | NMTGDLXCDBIMNE-UHFFFAOYSA-N |
| MDL Number | MFCD09743254 |
| Molecular Formula | C11H15ClN2O3 |
| Molecular Weight | 258.7014 |
| SMILES | Cl.COC1=CC(N2C(=O)OC(CN)C2)=CC=C1 |
| Synonyms | 5-(Aminomethyl)-3-(3-methoxyphenyl)-1,3-oxazolidin-2-one hydrochloride,
1177353-88-6,
AKOS022295654,
MCULE-8580520723,
L-4081,
F2147-0069,
|
| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.702g/mol |
| Monoisotopic Mass | 258.077g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 64.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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