| CAS Number | 1244059-96-8 |
| Catalog Number | AG00VT9L(AGN-PC-0WBKHQ) |
| Chemical Name | 2-(5-(tert-Butyl)-1,2,4-oxadiazol-3-yl)ethan-1-amine hydrochloride |
| IUPAC Name | 2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride |
| InChI | InChI=1S/C8H15N3O.ClH/c1-8(2,3)7-10-6(4-5-9)11-12-7;/h4-5,9H2,1-3H3;1H |
| InChI Key | SRBWVDKPYWDGQU-UHFFFAOYSA-N |
| MDL Number | MFCD19380108 |
| Molecular Formula | C8H16ClN3O |
| Molecular Weight | 205.6851 |
| SMILES | NCCC1=NOC(C(C)(C)C)=N1.[H]Cl |
| Synonyms | 1244059-96-8,
2-(5-(tert-butyl)-1,2,4-oxadiazol-3-yl)ethan-1-amine hydrochloride,
SCHEMBL3712851,
AKOS016352727,
MCULE-7852898885,
NS-02200,
F2185-0041,
2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethan-1-amine hydrochloride,
2-(5-tert-butyl-1,2,4-oxadiazol-3-yl)ethanamine;hydrochloride,
|
| Complexity | 144 |
| 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 | 3 |
| 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