| CAS Number | 1823310-95-7 |
| Catalog Number | AG01BUTX |
| Chemical Name | tert-Butyl 3-(5-amino-1,3,4-oxadiazol-2-yl)azetidine-1-carboxylate |
| IUPAC Name | tert-butyl 3-(5-amino-1,3,4-oxadiazol-2-yl)azetidine-1-carboxylate |
| InChI | InChI=1S/C10H16N4O3/c1-10(2,3)17-9(15)14-4-6(5-14)7-12-13-8(11)16-7/h6H,4-5H2,1-3H3,(H2,11,13) |
| InChI Key | WUAHDMPIDVMBKR-UHFFFAOYSA-N |
| MDL Number | MFCD22689238 |
| Molecular Formula | C10H16N4O3 |
| Molecular Weight | 240.2590 |
| SMILES | CC(OC(N1CC(C2OC(N)=NN=2)C1)=O)(C)C |
| Synonyms | 1823310-95-7,
tert-butyl 3-(5-amino-1,3,4-oxadiazol-2-yl)azetidine-1-carboxylate,
ZINC307137247,
1-Boc-3-(5-Amino-[1,3,4]oxadiazol-2-yl)-azetidine,
|
| Complexity | 298 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.263g/mol |
| Monoisotopic Mass | 240.122g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 94.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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