| CAS Number | 874622-81-8 |
| Catalog Number | AG019OSB |
| Chemical Name | 2-(morpholine-4-carbonyl)-3,4-dihydro-2H-1,4-benzoxazine |
| IUPAC Name | 3,4-dihydro-2H-1,4-benzoxazin-2-yl(morpholin-4-yl)methanone |
| InChI | InChI=1S/C13H16N2O3/c16-13(15-5-7-17-8-6-15)12-9-14-10-3-1-2-4-11(10)18-12/h1-4,12,14H,5-9H2 |
| InChI Key | VOOLCSDQKDNYCB-UHFFFAOYSA-N |
| MDL Number | MFCD07366465 |
| Molecular Formula | C13H16N2O3 |
| Molecular Weight | 248.2777 |
| SMILES | O=C(N1CCOCC1)C1OC2=C(C=CC=C2)NC1 |
| Synonyms | 2-(morpholine-4-carbonyl)-3,4-dihydro-2H-1,4-benzoxazine,
874622-81-8,
2-(morpholin-4-ylcarbonyl)-3,4-dihydro-2H-1,4-benzoxazine,
AC1Q5FV5,
CTK7G0285,
HMS1733K10,
AKOS000118413,
AKOS017279797,
MCULE-5811895588,
NE13643,
EN300-15066,
Z135437780,
|
| Complexity | 305 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.282g/mol |
| Monoisotopic Mass | 248.116g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number