| CAS Number | 1211284-37-5 |
| Catalog Number | AG01BUN0 |
| Chemical Name | 3-(1,3-benzothiazol-2-yl)oxetan-3-amine hydrochloride |
| IUPAC Name | 3-(1,3-benzothiazol-2-yl)oxetan-3-amine;hydrochloride |
| InChI | InChI=1S/C10H10N2OS.ClH/c11-10(5-13-6-10)9-12-7-3-1-2-4-8(7)14-9;/h1-4H,5-6,11H2;1H |
| InChI Key | JMPOAAHYJMIGDU-UHFFFAOYSA-N |
| MDL Number | MFCD17215866 |
| Molecular Formula | C10H11ClN2OS |
| Molecular Weight | 242.7251 |
| SMILES | Cl.NC1(C2SC3=C(C=CC=C3)N=2)COC1 |
| Synonyms | 1211284-37-5,
3-(1,3-benzothiazol-2-yl)oxetan-3-amine hydrochloride,
3-(2-benzothiazolyl)-3-oxetanamine hydrochloride,
|
| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.721g/mol |
| Monoisotopic Mass | 242.028g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 76.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number