| CAS Number | 1208452-70-3 |
| Catalog Number | AG019XFA(AGN-PC-0WOSVX) |
| Chemical Name | 2-(2,3-dihydro-1H-isoindol-2-yl)ethan-1-amine dihydrochloride |
| IUPAC Name | 2-(1,3-dihydroisoindol-2-yl)ethanamine;dihydrochloride |
| InChI | InChI=1S/C10H14N2.2ClH/c11-5-6-12-7-9-3-1-2-4-10(9)8-12;;/h1-4H,5-8,11H2;2*1H |
| InChI Key | CVLGKVMEWCLNQG-UHFFFAOYSA-N |
| MDL Number | MFCD13196141 |
| Molecular Formula | C10H16Cl2N2 |
| Molecular Weight | 235.1534 |
| SMILES | C1C2=CC=CC=C2CN1CCN.Cl.Cl |
| Synonyms | 2-(2,3-dihydro-1H-isoindol-2-yl)ethan-1-amine dihydrochloride,
1208452-70-3,
AC1Q3AVG,
CTK7E8648,
AKOS026742748,
MCULE-5718114033,
NE53838,
EN300-54840,
Z823287506,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.069g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.152g/mol |
| Monoisotopic Mass | 234.069g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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