| CAS Number | 852051-10-6 |
| Catalog Number | AG00G897(AGN-PC-0OJQS5) |
| Chemical Name | (R)-Benzyl 2-methyl-4-oxopiperidine-1-carboxylate |
| IUPAC Name | benzyl (2R)-2-methyl-4-oxopiperidine-1-carboxylate |
| InChI | InChI=1S/C14H17NO3/c1-11-9-13(16)7-8-15(11)14(17)18-10-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3/t11-/m1/s1 |
| InChI Key | NKUKIRSAMUEXPP-LLVKDONJSA-N |
| MDL Number | MFCD22682292 |
| Molecular Formula | C14H17NO3 |
| Molecular Weight | 247.2897 |
| SMILES | O=C(N1[C@H](C)CC(CC1)=O)OCC2=CC=CC=C2 |
| Synonyms | 852051-10-6,
(R)-BENZYL 2-METHYL-4-OXOPIPERIDINE-1-CARBOXYLATE,
benzyl (2R)-2-methyl-4-oxopiperidine-1-carboxylate,
(R)-1-Cbz-2-Methylpiperidin-4-one,
KS-000004EB,
MFCD22682292,
ZINC66347148,
FCH2894437,
SB11479,
AK173878,
AS-42178,
AJ-116367,
CS-0049904,
(R)-1-CBZ-2-METHYL-PIPERIDIN-4-ONE,
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| Complexity | 310 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 247.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 247.294g/mol |
| Monoisotopic Mass | 247.121g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number