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Alprenolol hydrochloride

CAT: 0013-GTR19157819-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19157819-01Size:1 g
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Description
Alprenolol hydrochloride is a non-selective blocker of beta, and also is a antagonist of5-HT1A receptor.
CAS Number
13707-88-5
Field of Research
Pharmacology & Drug Discovery
Purity
>98% (HPLC)
Solubility
DMSO:95 mg/mL (332.39 mM; Need ultrasonic) ; H2O:50 mg/mL (174.94 mM; Need ultrasonic)
Smiles
Cl.CC (C) NCC (O) COc1ccccc1CC=C
Molecular Formula
C15H24ClNO2
Molecular Weight
285.81
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Alprenolol Hydrochloride

See also: Alprenolol (has active moiety).

CAS Number13707-88-5
PubChem CID66368
IUPAC Name1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-ol;hydrochloride
Molecular FormulaC15H24ClNO2
Molecular Weight285.81
Topological Polar Surface Area41.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Heavy Atom Count19
Formal Charge0
Complexity231
SMILES
CC(C)NCC(COC1=CC=CC=C1CC=C)O.Cl
InChI
InChI=1S/C15H23NO2.ClH/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3;/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3;1H
InChIKey
RRCPAXJDDNWJBI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Alprenolol Hydrochloride
CAS: 13707-88-5
CID: 66368
Formula: C15H24ClNO2
MW: 285.81
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight285.81
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass285.1495567
Monoisotopic Mass285.1495567
Topological Polar Surface Area41.5 Ų
Heavy Atom Count19
Formal Charge0
Complexity231
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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