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Mabuterol

Mabuterol structure

CAS No:
56341-08-3
Formula:
C13H18ClF3N2O
Chemical Name:
Mabuterol
Synonyms:
Benzenemethanol,4-amino-3-chloro-α-[[(1,1-dimethylethyl)amino]methyl]-5-(trifluoromethyl)-;4-Amino-3-chloro-α-[[(1,1-dimethylethyl)amino]methyl]-5-(trifluoromethyl)benzenemethanol;Mabuterol;PB 868Cl;Ambuterol;(±)-Mabuterol;56707-24-5
Categories:
Active Pharmaceutical Ingredients > Respiratory Drugs

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Description

Yellow Solid

Mabuterol is a member of (trifluoromethyl)benzenes.

Mabuterol Basic Attributes

Molecular Weight：

310.74

Exact Mass：

310.74

EC Number：

1312995-182-4

DSSTox ID：

DTXSID3048283

HScode：

2922199090

Characteristics

PSA：

58.3

XLogP3：

4.33460

Density：

1.278g/cm3

Melting Point：

85-87°C

Boiling Point：

375.9ºC at 760mmHg

Flash Point：

181.1ºC

Refractive Index：

1.516

Storage Conditions：

Hygroscopic, -20°C Freezer, Under Inert Atmosphere

Collision Cross Section：

168.4 Å² [M+H]+ [CCS Type: TW]|169.44 Å² [M+H]+

Drug Information

MeSH：

Agents that cause an increase in the expansion of a bronchus or bronchial tubes. (See all compounds classified as Bronchodilator Agents.)|Drugs that selectively bind to and activate beta-adrenergic receptors. (See all compounds classified as Adrenergic beta-Agonists.)

MeSH Entry Terms：

4-amino-alpha-((tert-butylamino)methyl)-3-chloro-5-(trifluoromethyl)benzyl alcohol

Mabuterol Use and Manufacturing

A β2-adrenergic agonist, used as a bronchodilator/antiasthmatic

Computed Properties

Molecular Weight:310.74
XLogP3:2.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:310.1059754
Monoisotopic Mass:310.1059754
Topological Polar Surface Area:58.3
Heavy Atom Count:20
Complexity:320
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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high quality C13H18N2OF3Cl 99% transparent liquid KANBEI

CAS No.: 56341-08-3

Grade: Industrial Grade

Content: 99%

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