| CAS Number | 2137662-22-5 |
| Catalog Number | AG01EJPV |
| Chemical Name | methyl 1-amino-4-methoxy-2,3-dihydro-1H-indene-1-carboxylate hydrochloride |
| IUPAC Name | methyl 1-amino-4-methoxy-2,3-dihydroindene-1-carboxylate;hydrochloride |
| InChI | InChI=1S/C12H15NO3.ClH/c1-15-10-5-3-4-9-8(10)6-7-12(9,13)11(14)16-2;/h3-5H,6-7,13H2,1-2H3;1H |
| InChI Key | GUQJRTKPUCEIPM-UHFFFAOYSA-N |
| MDL Number | MFCD31558780 |
| Molecular Formula | C12H16ClNO3 |
| Molecular Weight | 257.7133 |
| SMILES | Cl.COC(C1(C2=CC=CC(OC)=C2CC1)N)=O |
| Synonyms | methyl 1-amino-4-methoxy-2,3-dihydro-1H-indene-1-carboxylate hydrochloride,
2137662-22-5,
|
| Complexity | 281 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 257.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 257.714g/mol |
| Monoisotopic Mass | 257.082g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 61.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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