Vernakalant hydrochloride

Basic Information

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CAS Number

748810-28-8

Molecular Formula

C20H32ClNO4

Molecular Weight

385.93 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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COC1=C(C=C(C=C1)CCOC2CCCCC2N3CCC(C3)O)OC.Cl

InChI

InChI=1S/C20H31NO4.ClH/c1-23-19-8-7-15(13-20(19)24-2)10-12-25-18-6-4-3-5-17(18)21-11-9-16(22)14-21;/h7-8,13,16-18,22H,3-6,9-12,14H2,1-2H3;1H/t16-,17-,18-;/m1./s1

InChIKey

JMHYCBFEEFHTMK-IIUXMCBISA-N

LogP

3.0625000000000027

Topological Polar Surface Area

51.16 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

394

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

AKOS027326204
Vernakalant HCl
MK-6621
Vernakalant (Hydrochloride)
DTXSID30976007
Vernakalant hydrochloride (USAN)
VERNAKALANT HYDROCHLORIDE [WHO-DD]
Vernakalant hydrochloride
Brinavess
CHEMBL2107383
UNII-7G4J1ZD9UQ
AS-58436
1-{2-[2-(3,4-Dimethoxyphenyl)ethoxy]cyclohexyl}pyrrolidin-3-ol--hydrogen chloride (1/1)
Kynapid
(3R)-1-[(1R,2R)-2-[2-(3,4-dimethoxyphenyl)ethoxy]cyclohexyl]pyrrolidin-3-ol;hydrochloride
SCHEMBL439679
A915186
D06665
(3R)-1-[(1R,2R)-2-[2-(3,4-Dimethoxyphenyl)ethoxy]cyclohexyl]-3-pyrrolidinol monohydrochloride
3-Pyrrolidinol, 1-((1R,2R)-2-(2-(3,4-dimethoxyphenyl)ethoxy)cyclohexyl)-, hydrochloride, (3R)-
7G4J1ZD9UQ
(3R)-1-((1R,2R)-2-(2-(3,4-dimethoxyphenyl)ethoxy)cyclohexyl)pyrrolidin-3-ol hydrochloride
(3R)-1-[(1R,2R)-2-[2-(3,4-dimethoxyphenyl)ethoxy]cyclohexyl]pyrrolidin-3-ol hydrochloride
JMHYCBFEEFHTMK-IIUXMCBISA-N
YEB81028
(R)-1-((1R,2R)-2-(3,4-dimethoxyphenethoxy)cyclohexyl)pyrrolidin-3-ol hydrochloride
VERNAKALANT HYDROCHLORIDE [MI]
VERNAKALANT HYDROCHLORIDE [EMA EPAR]
HY-14183
748810-28-8
C76396

MDL Number

MFCD09833303

FAQ

What regulatory guidelines apply to Vernakalant hydrochloride (CAS: 748810-28-8)?

Vernakalant hydrochloride (CAS: 748810-28-8) is subject to various regulatory guidelines including GHS classification for hazardous chemicals, REACH regulations in the EU, and FDA/EPA requirements for pharmaceuticals and chemical safety. Manufacturers and distributors must comply with these to ensure safe handling and disposal.

Are there alternatives to Vernakalant hydrochloride (CAS: 748810-28-8) in synthesis?

There are several alternatives to Vernakalant hydrochloride (CAS: 748810-28-8) in synthesis, such as other antiarrhythmic agents like ivabradine or newer formulations of vernakalant with different functional groups. These alternatives can offer similar pharmacological effects with varying synthesis complexities.

What is the market or research trend for Vernakalant hydrochloride (CAS: 748810-28-8)?

The market for Vernakalant hydrochloride (CAS: 748810-28-8) is growing due to its potential in treating atrial fibrillation. Research is focusing on optimizing its efficacy, safety, and delivery methods. Market trends indicate increasing demand in cardiovascular research and drug development sectors.

How should waste containing Vernakalant hydrochloride (CAS: 748810-28-8) be handled?

Waste containing Vernakalant hydrochloride (CAS: 748810-28-8) should be collected in appropriate containers and stored separately. It should be disposed of through professional waste disposal services to ensure compliance with environmental protection regulations. Incineration is a common method, but proper handling and documentation are essential to avoid environmental contamination.