5-Methylpiperidin-2-one - CAS 3298-16-6
Catalog: |
BB021506 |
Product Name: |
5-Methylpiperidin-2-one |
CAS: |
3298-16-6 |
Synonyms: |
5-methyl-2-piperidinone; 5-methylpiperidin-2-one |
IUPAC Name: | 5-methylpiperidin-2-one |
Description: | Oxidation of 5-Methylpiperidin-2-one was examined in the study of preparation fo lactams via oxidation of cyclic, tertiary and secondary amines. |
Molecular Weight: | 113.16 |
Molecular Formula: | C6H11NO |
Canonical SMILES: | CC1CCC(=O)NC1 |
InChI: | InChI=1S/C6H11NO/c1-5-2-3-6(8)7-4-5/h5H,2-4H2,1H3,(H,7,8) |
InChI Key: | NSRPFJGOCZUUHE-UHFFFAOYSA-N |
LogP: | 0.80840 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020377510-A1 | Derivatives of piperlongumine and uses thereof | 20190530 |
CN-109180564-A | A kind of preparation method of piperidines and its derivative | 20180920 |
US-2021198235-A1 | Derivatives of piperlongumine and uses thereof | 20171215 |
WO-2019103897-A1 | Derivatives of piperlongumine and uses thereof | 20171124 |
WO-2019040647-A1 | COMPOSITIONS AND METHODS FOR THE TREATMENT OF CANCER | 20170822 |
Complexity: | 101 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 113.084063974 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 113.084063974 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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