| CAS Number | 1797025-14-9 |
| Catalog Number | AG01AV0I |
| Chemical Name | 5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine hydrochloride |
| IUPAC Name | 5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine;hydrochloride |
| InChI | InChI=1S/C13H16ClN3O.ClH/c14-11-7-5-10(6-8-11)13-16-12(18-17-13)4-2-1-3-9-15;/h5-8H,1-4,9,15H2;1H |
| InChI Key | KBDXKTUXKXTOMJ-UHFFFAOYSA-N |
| MDL Number | MFCD27959409 |
| Molecular Formula | C13H17Cl2N3O |
| Molecular Weight | 302.1996 |
| SMILES | Cl.NCCCCCC1ON=C(C2=CC=C(Cl)C=C2)N=1 |
| Synonyms | 5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine hydrochloride,
1797025-14-9,
AKOS026327849,
MCULE-6731225905,
Z1777278756,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 301.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 302.199g/mol |
| Monoisotopic Mass | 301.075g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 64.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number