1-Boc-4-(4-methylphenyl)piperazine

Basic Information

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CAS Number

681482-19-9

Molecular Formula

C16H24N2O2

Molecular Weight

276.37 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CC1=CC=C(C=C1)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H24N2O2/c1-13-5-7-14(8-6-13)17-9-11-18(12-10-17)15(19)20-16(2,3)4/h5-8H,9-12H2,1-4H3

InChIKey

XWXGRCUZGMGJTK-UHFFFAOYSA-N

LogP

3.0521200000000013

Topological Polar Surface Area

32.78 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

322

Synonyms & References

English

SCHEMBL2056118
SY005827
tert-Butyl 4-(p-tolyl)piperazine-1-carboxylate
A867115
MFCD11872658
CS-0317332
tert-butyl 4-(4-methylphenyl)piperazine-1-carboxylate
1-BOC-4-(4-METHYLPHENYL)PIPERAZINE
J-524723
681482-19-9
AKOS015950589
FT-0732976
AS-31659
tert-butyl 4-p-tolylpiperazine-1-carboxylate
1-Boc-4-(4-methylphenyl)piperazine
1-Piperazinecarboxylic acid, 4-(4-methylphenyl)-, 1,1-dimethylethylester
4-(4-methylphenyl)-1-Piperazinecarboxylic acid 1,1-dimethylethyl ester
KM1177
RL04603
AB1000595
4-(p-Tolyl)piperazine-1-carboxylic acid tert-butyl ester

MDL Number

MFCD11872658

Customs Code

2933599090

FAQ

What regulatory guidelines apply to 1-Boc-4-(4-methylphenyl)piperazine (CAS: 681482-19-9)?

1-Boc-4-(4-methylphenyl)piperazine (CAS: 681482-19-9) falls under various regulatory guidelines depending on its use. It is subject to REACH regulations for substances imported into or manufactured in the European Union. In the USA, it is regulated by the FDA and EPA under the Toxic Substances Control Act (TSCA). Proper handling and disposal should comply with the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for hazard communication.

Are there alternatives to 1-Boc-4-(4-methylphenyl)piperazine in synthesis?

Alternatives to 1-Boc-4-(4-methylphenyl)piperazine include other piperazine derivatives such as 4-(4-methylphenyl)piperazine without the Boc protecting group, or related heterocyclic compounds like morpholine. These can serve as useful substitutes in synthetic chemistry, depending on the specific requirements of the reaction and the desired product.

What is the market or research trend for 1-Boc-4-(4-methylphenyl)piperazine (CAS: 681482-19-9)?

The market for 1-Boc-4-(4-methylphenyl)piperazine (CAS: 681482-19-9) is primarily driven by its use in pharmaceutical and academic research. Recent trends show increasing interest in its application as a precursor in drug discovery and as a model compound for studying piperazine-based structures. Research is also exploring its potential in materials science and as a chemical building block.

How should waste containing 1-Boc-4-(4-methylphenyl)piperazine (CAS: 681482-19-9) be handled?

Waste containing 1-Boc-4-(4-methylphenyl)piperazine (CAS: 681482-19-9) should be collected in appropriate containers lined with suitable absorbent material to prevent spillage. Incineration is a common method of disposal, but professional waste disposal services are recommended to ensure compliance with local regulations. Disposal should follow GHS guidelines for hazardous waste, including proper labeling and documentation of the waste handling process.