112946-90-4

Basic information

• Product Name: 1-[(2S)-2-[5-methoxy-2-(4-{methyl[2-(3,4,5-trimethoxyphenyl)ethyl]amino}butoxy)phenyl]-1,3-benzothiazol-3(2H)-yl]ethanone hydrochloride (1:1)
• CAS NO: 112946-90-4
• Molecular Formula: C₃₂H₄₀N₂O₆S*ClH
• Molecular Weight: 617.1957
• Mol File: 112946-90-4.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 739.7°C at 760 mmHg
• Flash Point: 401.2°C
• Vapor Pressure: 9.52E-22mmHg at 25°C
• CAS DataBase Reference: 1-[(2S)-2-[5-methoxy-2-(4-{methyl[2-(3,4,5-trimethoxyphenyl)ethyl]amino}butoxy)phenyl]-1,3-benzothiazol-3(2H)-yl]ethanone hydrochloride (1:1)(CAS DataBase Reference)
• NIST Chemistry Reference: 1-[(2S)-2-[5-methoxy-2-(4-{methyl[2-(3,4,5-trimethoxyphenyl)ethyl]amino}butoxy)phenyl]-1,3-benzothiazol-3(2H)-yl]ethanone hydrochloride (1:1)(112946-90-4)
• EPA Substance Registry System: 1-[(2S)-2-[5-methoxy-2-(4-{methyl[2-(3,4,5-trimethoxyphenyl)ethyl]amino}butoxy)phenyl]-1,3-benzothiazol-3(2H)-yl]ethanone hydrochloride (1:1)(112946-90-4)

Safety Data

• Hazardous Substances Data: 112946-90-4(Hazardous Substances Data)

Usage

Chemical structure

A complex structure containing a benzothiazol-3(2H)-yl moiety, an ethanone group, and a hydrochloride salt.

Functional groups

Contains a methoxy group and a methyl-amino-butoxy group attached to a phenyl ring.

Potential applications

Possible use in pharmaceuticals or organic synthesis due to its complex structure and the presence of the benzothiazol-3(2H)-yl group.

Biological activities

May have biological activities due to the presence of the benzothiazol-3(2H)-yl group.

Handling and storage

Proper handling, storage, and disposal measures must be taken into consideration when working with this compound due to its complex nature and the presence of a hydrochloride salt.

Solubility

The solubility of this compound is not mentioned in the provided material, but it is important to consider when working with it.

Stability

The stability of this compound under different conditions (e.g., temperature, light, humidity) is not mentioned in the provided material, but it is an important factor to consider for its use and storage.

Purity

The purity of the compound is not mentioned in the provided material, but it is crucial for its effectiveness and safety in potential applications.

Safety precautions

Specific safety precautions are not mentioned in the provided material, but it is essential to follow general laboratory safety guidelines when handling this compound.

Regulatory status

The regulatory status of this compound (e.g., approval for use in pharmaceuticals or organic synthesis) is not mentioned in the provided material, but it is an important factor to consider for its potential applications.

Upstream product

• 116502-54-6 (-)-(S)-3-acetyl-2-(2-hydroxy-5-methoxyphenyl)benzothiazoline 
• 4838-96-4 N-methyl-3,4,5-trimethoxyphenethylamine 
• 129170-47-4 (-)-(S)-3-acetyl-2-<2-(4-bromobutoxy)-5-methoxyphenyl>benzothiazoline 

Relevant articles and documents

Synthesis and calcium antagonistic activity of (+)-(R)- and (-)-(S)-3-acetyl-2-[5-methoxy-2-[4-[N-methyl-N-(3,4,5-trimethoxyphenet hyl)amino]butoxy]phenyl]benzothiazoline hydrochloride

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