| CAS Number | 1185297-76-0 |
| Catalog Number | AG009A2O |
| Chemical Name | [(5-isobutyl-1,2,4-oxadiazol-3-yl)methyl]methylamine hydrochloride |
| IUPAC Name | N-methyl-1-[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]methanamine;hydrochloride |
| InChI | InChI=1S/C8H15N3O.ClH/c1-6(2)4-8-10-7(5-9-3)11-12-8;/h6,9H,4-5H2,1-3H3;1H |
| InChI Key | XHFWHHZRURVKAY-UHFFFAOYSA-N |
| MDL Number | MFCD12026787 |
| Molecular Formula | C8H16ClN3O |
| Molecular Weight | 205.6851 |
| SMILES | N1=C(CC(C)C)ON=C1CNC.Cl |
| Synonyms | N-[(5-isobutyl-1,2,4-oxadiazol-3-yl)methyl]-N-methylamine hydrochloride,
1185297-76-0,
[(5-Isobutyl-1,2,4-oxadiazol-3-yl)methyl]methylamine hydrochloride,
1-(5-Isobutyl-1,2,4-oxadiazol-3-yl)-N-methylmethanamine hydrochloride,
CTK6I5541,
ZX-CM004856,
0295AD,
MFCD12026787,
AKOS015846701,
methyl({[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]methyl})amine hydrochloride,
C8H16ClN3O,
N/A,
915925-30-3,
|
| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.686g/mol |
| Monoisotopic Mass | 205.098g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 51A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number