| CAS Number | 110460-11-2 |
| Catalog Number | AG008R8H(AGN-PC-0P0OST) |
| Chemical Name | 2-[2-(methylamino)ethyl]-2,3-dihydro-1H-isoindole-1,3-dione hydrochloride |
| IUPAC Name | 2-[2-(methylamino)ethyl]isoindole-1,3-dione;hydrochloride |
| InChI | InChI=1S/C11H12N2O2.ClH/c1-12-6-7-13-10(14)8-4-2-3-5-9(8)11(13)15;/h2-5,12H,6-7H2,1H3;1H |
| InChI Key | PCHJQTVIFLSWMV-UHFFFAOYSA-N |
| MDL Number | MFCD08272837 |
| Molecular Formula | C11H13ClN2O2 |
| Molecular Weight | 240.6861 |
| SMILES | Cl.CNCCN1C(=O)C2=C(C=CC=C2)C1=O |
| Synonyms | 110460-11-2,
2-[2-(methylamino)ethyl]-2,3-dihydro-1H-isoindole-1,3-dione hydrochloride,
2-[2-(methylamino)ethyl]-1h-isoindole-1,3(2h)-dione hydrochloride,
2-[2-(METHYLAMINO)ETHYL]-1H-ISOINDOLE-1,3(2H)-DIONE, HCL SALT,
AKOS016890895,
MCULE-3945325463,
NE13805,
SC-35260,
2-[2-(methylamino)ethyl]-1H-Isoindole-1,3(2H)-dion,
2-[2-(methylamino)ethyl]-1H-Isoindole-1,3(2H)-dione,HCl Salt,
PCHJQTVIFLSWMV-UHFFFAOYSA-N,
|
| Complexity | 254 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.687g/mol |
| Monoisotopic Mass | 240.067g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number