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29122-68-7

29122-68-7 structural image
Product Name: Atenolol
Formula: C14H22N2O3
Synonyms: (±)-4-[2-Hydroxy-3-[(1-methylethyl)amino]propoxy]benzeneacetamide;4-[2′-Hydroxy-3′-(isopropylamino)propoxy]phenylacetamide;Atenolol
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Color/Form White, crystalline powder
Melting Point 158-160
Solubility >40 [ug/mL] (The mean of the results at pH 7.4)
LogP 0.16
Ionization Efficiency Positive
Caco2 Permeability -6.44
Dissociation Constants 9.58
Collision Cross Section 159.5 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)]
Other Experimental Properties Dipole moment 5.71 D @ 20 °C in propionic acid

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Flame
Flammables
GHS02

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H225:Flammable liquids
H319:Serious eye damage/eye irritation
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P337+P313:IF eye irritation persists: Get medical advice/attention.
P403+P235:Store in a well-ventilated place. Keep cool.

COMPUTED DESCRIPTORS

Molecular Weight 266.34 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 8
Exact Mass 266.16304257 g/mol
Monoisotopic Mass 266.16304257 g/mol
Topological Polar Surface Area 84.6 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 263
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Atenolol is an ethanolamine compound having a (4-carbamoylmethylphenoxy)methyl group at the 1-position and an N-isopropyl substituent. It has a role as a beta-adrenergic antagonist, an anti-arrhythmia drug, an antihypertensive agent, a sympatholytic agent, a xenobiotic and an environmental contaminant. It is a member of ethanolamines, a monocarboxylic acid amide and a propanolamine.

RELATED SUPPLIERS

AVD pharmaceuticals Pvt Ltd

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product:29122-68-7 S (-) Atenolol 98%

Frolic Pharmachem

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product:ATENOLOL IP 99%

KARPSCHEM LABORATORIES PVT. LTD.

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product:Atenolol 2-[4-[(2RS)-2-hydroxy-3-[(1-methylethyl)amino] propoxy]phenyl]acetamide 29122-68-7 96%

Ipca Laboratories Ltd

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Kopran Ltd

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Vani Pharma Labs Limited

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J.B. Chemicals Pharmaceuticals Ltd.

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Zydus Lifesciences Ltd.

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Molsyns Research

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product:29122-68-7 98%
All suppliers(13)