2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (1:1) | CAS No. 548-66-3

2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (1:1)

Basic Information

CAS Number

548-66-3

Molecular Formula

C20H32ClNO2

Molecular Weight

353.93 g/mol

AD

Basic Physical Properties

Melting Point

145-147°

CCN(CC)CCOC(=O)C(C1CCCCC1)C2=CC=CC=C2.Cl

InChI

InChI=1S/C20H31NO2.ClH/c1-3-21(4-2)15-16-23-20(22)19(17-11-7-5-8-12-17)18-13-9-6-10-14-18;/h5,7-8,11-12,18-19H,3-4,6,9-10,13-16H2,1-2H3;1H

InChIKey

WIELVDXKOYPANK-UHFFFAOYSA-N

LogP

4.657300000000005

Topological Polar Surface Area

29.54 Ų

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

329

Safety Information

View Safety Information

Toxicity

LD50 i.v. in mice: 65.6 mg/kg (Fleisch)

Synonyms & References

English

  • Drofenine hydrochloride, (+)-
  • NSC-42559
  • MLS002222187
  • CS-4885
  • Cyclohexaneacetic acid, alpha-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride, (+)-
  • 2-(diethylamino)ethyl 2-cyclohexyl-2-phenylacetate hydrochloride
  • WLN: L6TJ AYR&VO2N2&2 &GH
  • .alpha.-Phenylcyclohexaneacetic acid 2-(diethylamino)ethyl ester hydrochloride
  • DROFENINE HYDROCHLORIDE [MART.]
  • (+)-alpha-Phenylcyclohexaneacetic acid 2-(diethylamino)ethyl ester hydrochloride
  • Trasentine-6H hydrochloride
  • VU0244449-2
  • MLS002207270
  • SCHEMBL446912
  • Trasentine-A
  • Drofenine HCl
  • Tox21_111350_1
  • BT75TGU6AZ
  • 2-(Diethylamino)ethyl(.alpha.-phenylcyclohexane)acetate hydrochloride
  • 3146-20-1
  • .alpha.-Cyclohexylbenzeneacetic acid 2-(diethylamino)ethyl ester hydrochloride
  • Benzeneacetic acid, alpha-cyclohexyl-, 2-(diethylamino)ethyl ester, hydrochloride
  • CHEMBL1368313
  • NSC 42559
  • alpha-Phenyl-cyclohexylessigsaeure-2-diaethylamino-aethylester-hydrochlorid
  • HMS1921O20
  • Cyclohexaneacetic acid, 2-(diethylamino)ethyl ester hydrochloride
  • NSC757809
  • NCGC00178252-05
  • NS00080383
  • SMR001306793

MDL Number

MFCD00034983

FAQ

What regulatory guidelines apply to 2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (CAS: 548-66-3)?

The compound 2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (CAS: 548-66-3) is subject to various regulatory guidelines including GHS classification, REACH regulations, and FDA/EPA related requirements. It is important to adhere to these guidelines for safe handling, storage, and disposal. Users should consult the Material Safety Data Sheet (MSDS) for specific details and local regulations.

Are there alternatives to 2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (CAS: 548-66-3) in synthesis?

While 2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (CAS: 548-66-3) is a specific compound, there are other similar reagents that can be used as alternatives in synthesis. Examples include various diethylamino derivatives or different cyclic ketones with phenyl groups. These alternatives can offer similar reactivity profiles but with different functional groups, making them suitable for specific synthetic needs.

What is the market or research trend for 2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (CAS: 548-66-3)?

The market and research trends for 2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (CAS: 548-66-3) are closely tied to its application in pharmaceuticals and agrochemicals. There is ongoing interest in its use as a chiral auxiliary in asymmetric synthesis due to its unique structure. Recent research focuses on its potential in drug development and crop protection, with an emphasis on sustainable and environmentally friendly approaches.

How should waste containing 2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (CAS: 548-66-3) be handled?

Waste containing 2-(Diethylamino)ethyl cyclohexyl(phenyl)acetate hydrochloride (CAS: 548-66-3) should be collected in appropriate sealed containers and stored in a well-ventilated area away from direct sunlight and heat sources. It should be disposed of through a licensed hazardous waste management facility. Proper incineration or professional waste disposal services are recommended to ensure environmental safety and compliance with local regulations.

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