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Hydroquinidine hydrochloride

CAT: 0862-GK8747-100gSize: 100 gDry Ice: NoHazardous: No
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CAT#:0862-GK8747-100gSize:100 g
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CAS Number
1476-98-8
EC Number
216-024-1
HS Code
29392000
Purity
99.00%
Molecular Formula
C20H26N2O2 · HCl
Molecular Weight
362.89
Storage Conditions
+20°C
Hazardous Class
Not hazardous

Chemical Information

Hydroquinidine hydrochloride
CAS Number1476-98-8
PubChem CID16211709
IUPAC Name(S)-[(2R,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol;hydrochloride
Molecular FormulaC20H27ClN2O2
Molecular Weight362.9
Topological Polar Surface Area45.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity432
SMILES
CC[C@H]1CN2CC[C@H]1C[C@@H]2[C@H](C3=C4C=C(C=CC4=NC=C3)OC)O.Cl
InChI
InChI=1S/C20H26N2O2.ClH/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;/h4-6,8,11,13-14,19-20,23H,3,7,9-10,12H2,1-2H3;1H/t13-,14-,19+,20-;/m0./s1
InChIKey
MULXTQKDWYBJMO-VJAUXQICSA-N
Chemical Structure
2D Structure
2D structure of Hydroquinidine hydrochloride
CAS: 1476-98-8
CID: 16211709
Formula: C20H27ClN2O2
MW: 362.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight362.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass362.1761058
Monoisotopic Mass362.1761058
Topological Polar Surface Area45.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity432
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
OR1078218Hydroquinidine Hydrochloride
HY-W009065Hydroquinidine (hydrochloride)
GTR19163226-01Hydroquinidine
HY-B0997R-01Hydroquinidine (Standard)
279719-01Hydroquinidine HCl

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