8-benzyl-3,8-diazabicyclo[3.2.1]octane

Basic Information

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CAS Number

93428-56-9

Molecular Formula

C13H18N2

Molecular Weight

202.3 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

309 ºC

Density

1.074

Flash Point

131 ºC

SMILES

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C1CC2CNCC1N2CC3=CC=CC=C3

InChI

InChI=1S/C13H18N2/c1-2-4-11(5-3-1)10-15-12-6-7-13(15)9-14-8-12/h1-5,12-14H,6-10H2

InChIKey

KQCFTYDLIJTKLE-UHFFFAOYSA-N

LogP

1.6228000000000002

Topological Polar Surface Area

15.27 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

199

Synonyms & References

English

EN300-83317
AMY23883
AKOS016842433
KQCFTYDLIJTKLE-UHFFFAOYSA-N
8-(phenylmethyl)-3,8-diazabicyclo[3.2.1]octane
8-Benzyl-3,8-diazabicyclo[3.2.1]octane
CS-0054018
AKOS000282829
A844591
P13130
MFCD22379981
AS-79424
SB11211
SCHEMBL286992
FT-0689685
DTXSID20477194
8-BENZYL-3,8-DIAZA-BICYCLO[3.2.1]OCTANE
CHEMBL4998730
93428-56-9
SY129023
3,8-Diazabicyclo[3.2.1]octane,8-(phenylmethyl)-
8-benzyl-3,8-diazabicyclo[3.2.1]octane

MDL Number

MFCD22379981

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 8-benzyl-3,8-diazabicyclo[3.2.1]octane (CAS: 93428-56-9)?

8-Benzyl-3,8-diazabicyclo[3.2.1]octane (CAS 93428-56-9) falls under various regulatory guidelines depending on its intended use. It is classified under the Globally Harmonized System (GHS) for Classification and Labelling of Chemicals, with specific hazards and preventive measures. In the European Union, it is subject to REACH regulations for registration, evaluation, authorization, and restriction of chemicals. Additionally, it must comply with FDA and EPA requirements for use in pharmaceuticals and environmental protection, respectively.

Are there alternatives to 8-benzyl-3,8-diazabicyclo[3.2.1]octane (CAS: 93428-56-9) in synthesis?

Several alternatives to 8-benzyl-3,8-diazabicyclo[3.2.1]octane (CAS 93428-56-9) are available for synthetic purposes. Common alternatives include other heterocycles such as morpholine, piperidine, and pyrrolidine. These compounds can serve similar functional roles in organic synthesis due to their ring structure and basicity. Additionally, isomers and analogs like 8-aminocyclooctane-1,3-dione can be used as viable substitutes.

What is the market or research trend for 8-benzyl-3,8-diazabicyclo[3.2.1]octane (CAS: 93428-56-9)?

The market for 8-benzyl-3,8-diazabicyclo[3.2.1]octane (CAS 93428-56-9) is driven by its use in pharmaceuticals and as a precursor in organic synthesis. Research trends indicate a growing interest in its application for medicinal chemistry and drug discovery. Market trends show increasing demand due to its unique chemical properties, particularly its ability to form stable complexes with metal ions. The research field is expanding with new studies exploring its potential in catalysts and as a ligand in coordination chemistry.

How should waste containing 8-benzyl-3,8-diazabicyclo[3.2.1]octane (CAS: 93428-56-9) be handled?

Waste containing 8-benzyl-3,8-diazabicyclo[3.2.1]octane (CAS 93428-56-9) should be managed according to relevant environmental regulations. Waste liquid collection should be done in a sealed, labeled container to prevent spillage and contamination. Incineration or professional waste disposal services are recommended, as this compound may require special handling due to its chemical properties. Environmental protection precautions include proper labeling, storage in a secure area, and adherence to local, national, and international waste management guidelines to ensure safe disposal and minimize environmental impact.