AC1MHWCX structure

AC1MHWCX

(4aR,8aR)-3-ethyl-2,6-dimethyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one;hydrochloride

Also Known As: PIQUINDONE HYDROCHLORIDE|Ro 22-1319|Ro 22-1319 hydrochloride, (trans(+-))-isomer|(4aR,8aR)-3-Ethyl-2,6-dimethyl-1,4a,5,6,7,8,8a,9-octahydro-4H-pyrrolo[2,3-g]isoquinolin-4-one--hydrogen chloride (1/1)|(4aR,8aR)-3-ethyl-2,6-dimethyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one hydrochloride|4H-Pyrrolo(2,3-g)isoquinolin-4-one, 1,4a,5,6,7,8,8a,9-octahydro-2,6-dimethyl-3-ethyl-, hydrochloride, trans-(+-)-|4H-Pyrrolo(2,3-g)isoquinolin-4-one, 1,4a,5,6,7,8,8a,9-octahydro-2,6-dimethyl-3-ethyl-,hydrochloride, trans-(+-)-

CAS: 75689-38-2
Molecular Formula C15H23ClN2O
Molecular Weight 282.1499 g/mol
LogP 2.61402
Topological Polar Surface Area 36.1 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
Rotatable Bonds 1
Exact Mass 282.1499
Monoisotopic Mass 282.1499
Heavy Atoms 19
Complexity 494.58017

Chemical Identifiers

CAS Number 75689-38-2
SMILES CCC1=C(NC2=C1C(=O)[C@H]3CN(CC[C@@H]3C2)C)C.Cl

Product Overview

AC1MHWCX (CAS 75689-38-2), with molecular formula C15H23ClN2O and molecular weight 282.1499 g/mol. IUPAC: (4aR,8aR)-3-ethyl-2,6-dimethyl-4a,5,7,8,8a,9-hexahydro-1H-pyrrolo[2,3-g]isoquinolin-4-one;hydrochloride.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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