| CAS Number | 1258641-37-0 |
| Catalog Number | AG01AAF5(AGN-PC-0WORV6) |
| Chemical Name | 5-(1-aminoethyl)-1-methyl-2,3-dihydro-1H-indol-2-one hydrochloride |
| IUPAC Name | 5-(1-aminoethyl)-1-methyl-3H-indol-2-one;hydrochloride |
| InChI | InChI=1S/C11H14N2O.ClH/c1-7(12)8-3-4-10-9(5-8)6-11(14)13(10)2;/h3-5,7H,6,12H2,1-2H3;1H |
| InChI Key | CSMLKMXPWAUBRN-UHFFFAOYSA-N |
| MDL Number | MFCD17480359 |
| Molecular Formula | C11H15ClN2O |
| Molecular Weight | 226.7026 |
| SMILES | Cl.CC(C1=CC2=C(N(C(C2)=O)C)C=C1)N |
| Synonyms | 5-(1-aminoethyl)-1-methyl-2,3-dihydro-1H-indol-2-one hydrochloride,
1258641-37-0,
AC1Q3982,
AKOS026742041,
NE29770,
EN300-68423,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.704g/mol |
| Monoisotopic Mass | 226.087g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number