| CAS Number | 1404364-80-2 |
| Catalog Number | AG01FFUC(AGN-PC-3H4AFE) |
| Chemical Name | tert-butyl 4-((5-(methoxycarbonyl)-1-methyl-1H-pyrazol-3-yl)oxy)piperidine-1-carboxylate |
| IUPAC Name | tert-butyl 4-(5-methoxycarbonyl-1-methylpyrazol-3-yl)oxypiperidine-1-carboxylate |
| InChI | InChI=1S/C16H25N3O5/c1-16(2,3)24-15(21)19-8-6-11(7-9-19)23-13-10-12(14(20)22-5)18(4)17-13/h10-11H,6-9H2,1-5H3 |
| InChI Key | GICJPZSCRXHGJH-UHFFFAOYSA-N |
| MDL Number | MFCD21332850 |
| Molecular Formula | C16H25N3O5 |
| Molecular Weight | 339.3868 |
| SMILES | |
| Synonyms | 1404364-80-2,
Tert-butyl 4-((5-(methoxycarbonyl)-1-methyl-1h-pyrazol-3-yl)oxy)piperidine-1-carboxylate,
MFCD21332850,
ZINC95099742,
t-Butyl 4-((5-(methoxycarbonyl)-1-methyl-1H-pyrazol-3-yl)oxy)piperidine-1-carboxylate,
tert-Bu 4-((5-(methoxycarbonyl)-1-Me-1H-pyrazol-3yl)oxy)piperidine-1-carboxylate, AldrichCPR,
|
| Complexity | 457 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 339.179g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 339.392g/mol |
| Monoisotopic Mass | 339.179g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 82.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number