| CAS Number | 1932238-01-1 |
| Catalog Number | AG00I2WV(AGN-PC-0WR30F) |
| Chemical Name | (3AR,4R,6aS)-tert-butyl 4-aminohexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate |
| IUPAC Name | tert-butyl (3aR,4R,6aS)-4-amino-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carboxylate |
| InChI | InChI=1S/C12H22N2O2/c1-12(2,3)16-11(15)14-6-8-4-5-10(13)9(8)7-14/h8-10H,4-7,13H2,1-3H3/t8-,9+,10-/m1/s1 |
| InChI Key | VMUXGMBHACBHJJ-KXUCPTDWSA-N |
| MDL Number | MFCD22397534 |
| Molecular Formula | C12H22N2O2 |
| Molecular Weight | 226.3153 |
| SMILES | Ic1cn2c(c1)CN(C2=O)CC[C@@](S(=O)(=O)C)(C(=O)OC(C)(C)C)C |
| Synonyms | (3AR,4R,6aS)-tert-butyl 4-aminohexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate,
1251012-14-2,
tert-Butyl (3aR,4R,6aS)-rel-4-aminohexahydrocyclopenta[c]pyrrole-2(1H)-carboxylate,
ZINC91304827,
AKOS027336793,
AM805796,
CS-0058792,
Racemic-cis-dihydrogen-2-boc-octahydro-cyclopenta[c]pyrrol-4-ylamine,
Racemiccis-dihydrogen-2-Boc-octahydro-cyclopenta[c]pyrrol-4-ylamine,
1932238-01-1,
40546-33-6,
|
| Complexity | 285 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.32g/mol |
| Monoisotopic Mass | 226.168g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number