(3aS)-2-(3R)-1-Azabicyclo[2.2.2]oct-3-yl-2,3,3a,4,5,6-hexahydro-1H-benz[de]isoquinolin-1-one hydrochloride (1:1), 95%+

cas: 135729-76-9 — see every product listed under this CAS number, including other names

(3aS)-2-(3R)-1-Azabicyclo[2.2.2]oct-3-yl-2,3,3a,4,5,6-hexahydro-1H-benz[de]isoquinolin-1-one hydrochloride (1:1), 95%+ (CAS 135729-76-9) is a chemical reagent available from Chemat. Available pack sizes: 100mg. Offered by: Chemat.

brandChemat
catalog numberCh110EH9-100mg
cas135729-76-9
size100mg
availability 0.2g
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Available pack sizes

brand size price
Chemat 100mg 2541.20 Pln

properties

purity95%+
delivery time3 weeks
Structural formula: {0} (CAS {1})

(3aS)-2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-3a,4,5,6-tetrahydro-3H-benzo[de]isoquinolin-1-one;hydrochloride (CAS 135729-76-9) is a chemical compound with the molecular formula C19H25ClN2O and a molecular weight of 332.9 g/mol. IUPAC name: (3aS)-2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-3a,4,5,6-tetrahydro-3H-benzo[de]isoquinolin-1-one;hydrochloride. InChIKey: OLDRWYVIKMSFFB-KALLACGZSA-N.

Identity
Molecular formulaC19H25ClN2O
Molecular weight332.9 g/mol
IUPAC name(3aS)-2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-3a,4,5,6-tetrahydro-3H-benzo[de]isoquinolin-1-one;hydrochloride
InChIKeyOLDRWYVIKMSFFB-KALLACGZSA-N
SMILESC1C[C@@H]2CN(C(=O)C3=CC=CC(=C23)C1)[C@H]4CN5CCC4CC5.Cl

Computed by PubChem (NCBI)

Synonyms: (S,R)-Palonosetron Hydrochloride, (S,R)-Palonosetron HCl, Palonosetron hydrochloride, (3R)-, (S,R)Palonosetron HCl, (S,R)-Palonosetron Hydrochloride Contains up to ~35% (R,R)-isomer, (S,R)-Palonosetron Hydrochloride Contains ~35per cent (R,R)-isomer
Related forms of this compound
(3aR)-2-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3a,4,5,6-tetrahydro-3H-benzo[de]isoquinolin-1-one;hydrochloride C19H25ClN2O
(3aR)-2-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-3a,4,5,6-tetrahydro-3H-benzo[de]isoquinolin-1-one;hydrochloride C19H25ClN2O
(3aS)-2-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-3a,4,5,6-tetrahydro-3H-benzo[de]isoquinolin-1-one;hydrochloride C19H25ClN2O
(3aS)-3,3-dideuterio-2-[(3S)-3-deuterio-1-azabicyclo[2.2.2]octan-3-yl]-3a,4,5,6-tetrahydrobenzo[de]isoquinolin-1-one;hydrochloride C19H25ClN2O
Isomers (same molecular formula)
3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine oxide;hydrochloride C19H25ClN2O
(1R,15R,17S,18S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol;hydrochloride C19H25ClN2O
2-[(E)-1-(4-methylphenyl)-3-pyrrolidin-1-ylprop-1-enyl]pyridine;hydrate;hydrochloride C19H25ClN2O

Also listed as

(S,R)-Palonosetron HCl Chemat Brand CAS 135729-76-9
(S,R)-Palonosetron Hydrochloride Contains up to ~35% (R,R)-isomer TRC CAS 135729-76-9
(S)-2-((R)-Quinuclidin-3-yl)-2,3,3a,4,5,6-hexahydro-1H-benzo(de)isoquinolin-1-one hydrochloride, 97% AmBeed CAS 135729-76-9