| CAS Number | 1172922-15-4 |
| Catalog Number | AG019NC3(AGN-PC-0WOUCB) |
| Chemical Name | [1-(1,3-Benzothiazol-2-yl)ethyl](methyl)amine hydrochloride |
| IUPAC Name | 1-(1,3-benzothiazol-2-yl)-N-methylethanamine;hydrochloride |
| InChI | InChI=1S/C10H12N2S.ClH/c1-7(11-2)10-12-8-5-3-4-6-9(8)13-10;/h3-7,11H,1-2H3;1H |
| InChI Key | AOADVJZRKFXADP-UHFFFAOYSA-N |
| MDL Number | MFCD11505543 |
| Molecular Formula | C10H13ClN2S |
| Molecular Weight | 228.7416 |
| SMILES | Cl.CNC(C1SC2=C(C=CC=C2)N=1)C |
| Synonyms | [1-(1,3-benzothiazol-2-yl)ethyl](methyl)amine hydrochloride,
1172922-15-4,
N-[1-(1,3-benzothiazol-2-yl)ethyl]-N-methylamine hydrochloride,
AC1Q3BPB,
CTK6I4666,
AKOS026743718,
NE25963,
EN300-39955,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.738g/mol |
| Monoisotopic Mass | 228.049g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 53.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number