| CAS Number | 1219911-62-2 |
| Catalog Number | AG01AR3X(AGN-PC-0WCOEL) |
| Chemical Name | Tert-butyl 4-(5-formylfuran-2-yl)piperazine-1-carboxylate |
| IUPAC Name | tert-butyl 4-(5-formylfuran-2-yl)piperazine-1-carboxylate |
| InChI | InChI=1S/C14H20N2O4/c1-14(2,3)20-13(18)16-8-6-15(7-9-16)12-5-4-11(10-17)19-12/h4-5,10H,6-9H2,1-3H3 |
| InChI Key | FNNOEZIWGHIYEM-UHFFFAOYSA-N |
| MDL Number | MFCD16631962 |
| Molecular Formula | C14H20N2O4 |
| Molecular Weight | 280.3196 |
| SMILES | CC(OC(N1CCN(C2OC(C=O)=CC=2)CC1)=O)(C)C |
| Synonyms | tert-butyl 4-(5-formylfuran-2-yl)piperazine-1-carboxylate,
1219911-62-2,
ZINC42379513,
AKOS015918390,
MCULE-4406664057,
I14-8571,
F2193-0010,
|
| Complexity | 359 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 280.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.324g/mol |
| Monoisotopic Mass | 280.142g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 63A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number