| CAS Number | 2135344-99-7 |
| Catalog Number | AG01DU7X |
| Chemical Name | 3-[(2S)-pyrrolidin-2-yl]aniline dihydrochloride |
| IUPAC Name | 3-[(2S)-pyrrolidin-2-yl]aniline;dihydrochloride |
| InChI | InChI=1S/C10H14N2.2ClH/c11-9-4-1-3-8(7-9)10-5-2-6-12-10;;/h1,3-4,7,10,12H,2,5-6,11H2;2*1H/t10-;;/m0../s1 |
| InChI Key | GLKASUHDSGOEJJ-XRIOVQLTSA-N |
| MDL Number | MFCD31556142 |
| Molecular Formula | C10H16Cl2N2 |
| Molecular Weight | 235.1534 |
| SMILES | NC1=CC=CC([C@H]2NCCC2)=C1.[H]Cl.[H]Cl |
| Synonyms | Benzenamine, 3-(2S)-2-pyrrolidinyl-, hydrochloride (1:2),
2135344-99-7,
|
| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 1 |
| 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 | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.152g/mol |
| Monoisotopic Mass | 234.069g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number