| CAS Number | 18596-80-0 |
| Catalog Number | AG01BG3C(AGN-PC-002T9N) |
| Chemical Name | 5-Methoxy-3,6-dihydro-2H-oxazine |
| IUPAC Name | 5-methoxy-3,6-dihydro-2H-1,4-oxazine |
| InChI | InChI=1S/C5H9NO2/c1-7-5-4-8-3-2-6-5/h2-4H2,1H3 |
| InChI Key | VDRWGEPHOPCAAB-UHFFFAOYSA-N |
| MDL Number | MFCD18633123 |
| Molecular Formula | C5H9NO2 |
| Molecular Weight | 115.1305 |
| SMILES | COC1COCCN=1 |
| Synonyms | 5-methoxy-3,6-dihydro-2H-oxazine,
18596-80-0,
2H-1,4-Oxazine,3,6-dihydro-5-methoxy-,
SCHEMBL182213,
ZINC34385359,
AKOS006373735,
|
| Complexity | 101 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 115.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 115.132g/mol |
| Monoisotopic Mass | 115.063g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
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Certificate of Analysis
Lot Number