| CAS Number | 1342956-55-1 |
| Catalog Number | AG019ENZ(AGN-PC-0WG3PS) |
| Chemical Name | 4-Methyl-1-(piperidin-1-yl)pentan-1-one |
| IUPAC Name | 4-methyl-1-piperidin-1-ylpentan-1-one |
| InChI | InChI=1S/C11H21NO/c1-10(2)6-7-11(13)12-8-4-3-5-9-12/h10H,3-9H2,1-2H3 |
| InChI Key | OLEKOHZAOLNNGQ-UHFFFAOYSA-N |
| MDL Number | MFCD20355065 |
| Molecular Formula | C11H21NO |
| Molecular Weight | 183.2905 |
| SMILES | CC(C)CCC(=O)N1CCCCC1 |
| Synonyms | 4-METHYL-1-(PIPERIDIN-1-YL)PENTAN-1-ONE,
1342956-55-1,
SCHEMBL12197927,
OLEKOHZAOLNNGQ-UHFFFAOYSA-N,
MFCD20355065,
AKOS008927737,
4-methyl-1-piperidin-1-ylpentan-1-one,
4-Methyl-1-piperidine-1-ylpentan-1-one,
CS-0036782,
4-methyl-1-(piperidin-1-yl)pentan-1-one(WXC06459),
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.162g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.295g/mol |
| Monoisotopic Mass | 183.162g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number