| CAS Number | 101250-44-6 |
| Catalog Number | AG00041O(AGN-PC-0NV62G) |
| Chemical Name | (5S)-5-(2-methylpropyl)morpholin-3-one |
| IUPAC Name | (5S)-5-(2-methylpropyl)morpholin-3-one |
| InChI | InChI=1S/C8H15NO2/c1-6(2)3-7-4-11-5-8(10)9-7/h6-7H,3-5H2,1-2H3,(H,9,10)/t7-/m0/s1 |
| InChI Key | DEWNYTYFDBHKCT-ZETCQYMHSA-N |
| MDL Number | MFCD27940846 |
| Molecular Formula | C8H15NO2 |
| Molecular Weight | 157.2102 |
| SMILES | CC(C[C@@H]1NC(=O)COC1)C |
| Synonyms | 3-Morpholinone, 5-(2-methylpropyl)-, (5S)-,
101250-44-6,
(5S)-5-(2-methylpropyl)morpholin-3-one,
SCHEMBL1004978,
(S)-5-iso-butylmorpholin-3-one,
DEWNYTYFDBHKCT-ZETCQYMHSA-N,
ZINC115010815,
(S)-5-(2-methylpropyl)-3-morpholinone,
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| Complexity | 145 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.213g/mol |
| Monoisotopic Mass | 157.11g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number