| CAS Number | 1909325-29-6 |
| Catalog Number | AG01C35Y |
| Chemical Name | 6-(2-oxopropyl)piperidin-2-one |
| IUPAC Name | 6-(2-oxopropyl)piperidin-2-one |
| InChI | InChI=1S/C8H13NO2/c1-6(10)5-7-3-2-4-8(11)9-7/h7H,2-5H2,1H3,(H,9,11) |
| InChI Key | DGANTWQYJYPOKY-UHFFFAOYSA-N |
| MDL Number | MFCD29060338 |
| Molecular Formula | C8H13NO2 |
| Molecular Weight | 155.1943 |
| SMILES | CC(CC1NC(=O)CCC1)=O |
| Synonyms | 6-(2-oxopropyl)piperidin-2-one,
1909325-29-6,
AKOS033866454,
Z2327226252,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.197g/mol |
| Monoisotopic Mass | 155.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
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Certificate of Analysis
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