| CAS Number | 1247780-89-7 |
| Catalog Number | AG01ABAW(AGN-PC-0WOC0Y) |
| Chemical Name | 1-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperazine |
| IUPAC Name | 3-methyl-5-(1-piperazin-1-ylethyl)-1,2,4-oxadiazole |
| InChI | InChI=1S/C9H16N4O/c1-7(9-11-8(2)12-14-9)13-5-3-10-4-6-13/h7,10H,3-6H2,1-2H3 |
| InChI Key | RNZABCDPRFSXQG-UHFFFAOYSA-N |
| MDL Number | MFCD16789487 |
| Molecular Formula | C9H16N4O |
| Molecular Weight | 196.2495 |
| SMILES | CC(C1ON=C(C)N=1)N1CCNCC1 |
| Synonyms | 1-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperazine,
1247780-89-7,
SCHEMBL15219259,
AKOS011593383,
MCULE-7887003826,
NE24138,
EN300-71045,
Z1266823346,
|
| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.254g/mol |
| Monoisotopic Mass | 196.132g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 54.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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Certificate of Analysis
Lot Number