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Butopamine

Butopamine structure

CAS No:
66734-12-1
Formula:
C18H23NO3
Chemical Name:
Butopamine
Synonyms:
Benzenemethanol,4-hydroxy-α-[[[(1R)-3-(4-hydroxyphenyl)-1-methylpropyl]amino]methyl]-,(αR)-;Benzenemethanol,4-hydroxy-α-[[[3-(4-hydroxyphenyl)-1-methylpropyl]amino]methyl]-,[R-(R*,R*)]-;(αR)-4-Hydroxy-α-[[[(1R)-3-(4-hydroxyphenyl)-1-methylpropyl]amino]methyl]benzenemethanol;Butopamine;LY 131126
Categories:
Organic Chemistry > Amides

Description

ChEBI: A 4-(1-hydroxy-2-{[4-(4-hydroxyphenyl)butan-2-yl]amino}ethyl)phenol in which both stereocentres have R configuration. It is the most active of the four diastereoisomers that make up the animal feed additive ractopamine.

Butopamine is a 4-(1-hydroxy-2-{[4-(4-hydroxyphenyl)butan-2-yl]amino}ethyl)phenol in which both stereocentres have R configuration. It is the most active of the four diastereoisomers that make up the animal feed additive ractopamine. It has a role as a beta-adrenergic agonist and an animal growth promotant. It is an enantiomer of an ent-butopamine.

Butopamine Basic Attributes

Molecular Weight：

301.386

Exact Mass：

301.38

UNII：

ZX7907IE2H

DSSTox ID：

DTXSID50216876

Characteristics

PSA：

72.7

XLogP3：

3.13300

Density：

1.189g/cm3

Boiling Point：

520.5ºC at 760 mmHg

Flash Point：

165.3ºC

Refractive Index：

1.608

Drug Information

MeSH Entry Terms：

butopamine

Computed Properties

Molecular Weight:301.4
XLogP3:2.7
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:301.16779360
Monoisotopic Mass:301.16779360
Topological Polar Surface Area:72.7
Heavy Atom Count:22
Complexity:297
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes