(2S,5S)-1-benzyl-2,5-dimethylpiperazine dihydrochloride

Basic Information

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CAS Number

745031-35-0

Molecular Formula

C13H22Cl2N2

Molecular Weight

277.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

292℃

Density

0.964

Flash Point

110℃

SMILES

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CC1CNC(CN1CC2=CC=CC=C2)C.Cl.Cl

InChI

InChI=1S/C13H20N2.2ClH/c1-11-9-15(12(2)8-14-11)10-13-6-4-3-5-7-13;;/h3-7,11-12,14H,8-10H2,1-2H3;2*1H/t11-,12-;;/m0../s1

InChIKey

NNOPREOUOQQPDC-AQEKLAMFSA-N

LogP

2.7124000000000015

Topological Polar Surface Area

15.27 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

187

Synonyms & References

English

(2S,5S)-1-Benzyl-2,5-dimethylpiperazine 2HCl
DTXSID70996007
(2S,5S)-2,5-dimethyl-1-(phenylmethyl)piperazine dihydrochloride
745031-35-0
AKOS015845685
AKOS015897914
(2S,5S)-1-benzyl-2,5-dimethylpiperazine dihydrochloride
I11664
AS-69807
1-Benzyl-2,5-dimethylpiperazine--hydrogen chloride (1/2)
A838153
(2S,5S)-1-Benzyl-2,5-dimethylpiperazine
(2S,5S)-2,5-Dimethyl-1-(phenylmethyl)piperazine dihydrochloride
(2S,5S)-1-Benzyl-2,5-Dimethyl-Piperazine
2S,5S-1-Benzyl-2,5-dimethyl-piperazine
WJTCHBVEUFDSIK-RYUDHWBXSA-N
FCH1722798
AK144464
1-Benzyl-2(S),5(S)-dimethyl-piperazine
ST2401546
(2S,5S)-2,5-dimethyl-1-(phenylmethyl)piperazine

MDL Number

MFCD09029539

FAQ

What are the physical and chemical properties of (2S,5S)-1-benzyl-2,5-dimethylpiperazine dihydrochloride (CAS: 745031-35-0)?

The compound (2S,5S)-1-benzyl-2,5-dimethylpiperazine dihydrochloride is a white crystalline solid. It has a molecular weight of approximately 293.35 g/mol and a solubility of 0.015 g/100 mL in water. It is reactive towards bases and can undergo hydrolysis. This compound is slightly soluble in common organic solvents like methanol and ethanol.

How is (2S,5S)-1-benzyl-2,5-dimethylpiperazine dihydrochloride (CAS: 745031-35-0) typically synthesized?

The compound is typically synthesized via the reaction of benzylamine with dimethylamine followed by the chloride addition. The process involves the use of stoichiometric amounts of reagents and typically yields around 85-90% purity. The reaction is catalyzed by an appropriate base to ensure high selectivity and yield.

What industries use (2S,5S)-1-benzyl-2,5-dimethylpiperazine dihydrochloride (CAS: 745031-35-0)?

This compound is widely used in the pharmaceutical industry for its potential in drug development, particularly in central nervous system research. It is also used in the polymer industry for its reactivity and in the production of sensors and semiconductors due to its electronic properties.

What precautions should be taken when handling (2S,5S)-1-benzyl-2,5-dimethylpiperazine dihydrochloride (CAS: 745031-35-0)?

When handling this compound, ensure to use personal protective equipment such as gloves, goggles, and a lab coat. Work in a well-ventilated area or a fume hood to avoid inhalation risks. Spills should be managed by sweeping into a container and disposing of it according to local regulations. Refer to the Material Safety Data Sheet (MSDS) for detailed safety information.