| CAS Number | 201145-61-1 |
| Catalog Number | AG01BCS6(AGN-PC-0O7338) |
| Chemical Name | 3-[(morpholin-4-yl)methyl]oxan-4-one hydrochloride |
| IUPAC Name | 3-(morpholin-4-ylmethyl)oxan-4-one;hydrochloride |
| InChI | InChI=1S/C10H17NO3.ClH/c12-10-1-4-14-8-9(10)7-11-2-5-13-6-3-11;/h9H,1-8H2;1H |
| InChI Key | ZSKMLQNWXJIJIX-UHFFFAOYSA-N |
| MDL Number | MFCD15201193 |
| Molecular Formula | C10H18ClNO3 |
| Molecular Weight | 235.7078 |
| SMILES | Cl.O=C1C(CN2CCOCC2)COCC1 |
| Synonyms | 3-(morpholin-4-ylmethyl)oxan-4-one hydrochloride,
201145-61-1,
AKOS026744315,
NE26419,
3-[(Morpholin-4-yl)methyl]oxan-4-one hydrochloride,
3-(morpholin-4-ylmethyl)tetrahydro-4H-pyran-4-one hydrochloride,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.708g/mol |
| Monoisotopic Mass | 235.098g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number