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Bufuralol

Bufuralol structure

CAS No:
54340-62-4
Formula:
C16H23NO2
Chemical Name:
Bufuralol
Synonyms:
2-Benzofuranmethanol,α-[[(1,1-dimethylethyl)amino]methyl]-7-ethyl-;α-[[(1,1-Dimethylethyl)amino]methyl]-7-ethyl-2-benzofuranmethanol;Bufuralol;Ro 3-4787;dl-Bufuralol;(±)-Bufuralol;2-(tert-Butylamino)-1-(7-ethylbenzofuran-2-yl)ethanol;57704-15-1
Categories:
Organic Chemistry > Amides

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Description

Bufuralol is a member of benzofurans.|Bufuralol is a new, non-selective -adrenoceptor blocking agent.

Bufuralol Basic Attributes

Molecular Weight：

261.363

Exact Mass：

261.36

EC Number：

259-112-5

Characteristics

PSA：

45.40000

XLogP3：

3.80760

Appearance：

white to off-white

Density：

1.066g/cm3

Melting Point：

143-146 °C

Boiling Point：

393.2ºC at 760 mmHg

Flash Point：

191.6ºC

Refractive Index：

1.558

Storage Conditions：

2-8°C

Safety Information

wgk germany：

hazard class code：

Marks：

Drug Information

MeSH：

Drugs that bind to but do not activate beta-adrenergic receptors thereby blocking the actions of beta-adrenergic agonists. Adrenergic beta-antagonists are used for treatment of hypertension, cardiac arrhythmias, angina pectoris, glaucoma, migraine headaches, and anxiety. (See all compounds classified as Adrenergic beta-Antagonists.)

Metabolism/Metabolites：

Bufuralol has known human metabolites that include 1'2'-Ethenylbufuralol, 4-Hydroxybufuralol, and 6-Hydroxubufuralol.

MeSH Entry Terms：

bufuralol

Computed Properties

Molecular Weight:261.36
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:261.172878976
Monoisotopic Mass:261.172878976
Topological Polar Surface Area:45.4
Heavy Atom Count:19
Complexity:287
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes