3,9-Diazaspiro[5.5]undecan-2-one

Basic Information

View in Editor

CAS Number

867006-20-0

Molecular Formula

C9H16N2O

Molecular Weight

168.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

369.8℃ at 760 mmHg

SMILES

View in Editor

O=C1CC2(CCNCC2)CCN1

InChI

InChI=1S/C9H16N2O/c12-8-7-9(3-6-11-8)1-4-10-5-2-9/h10H,1-7H2,(H,11,12)

InChIKey

IAXNSRPALMNQBY-UHFFFAOYSA-N

LogP

0.2661999999999998

Topological Polar Surface Area

41.13 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

185

Synonyms & References

English

3,9-Diazaspiro[5.5]undecan-2-one
3,9-diazaspiro[5.5]undecan-2-one TFA salt
3,9-diazaspiro[5.5]undecan-4-one
3,9-Diazaspiro[5.5]undecane-2-one
SB13787
FCH1123874
OR306347
AX8226174
3,9-diazaspiro[5.5]undecan-2-oneTFAsalt
ST2404670
W8902
3,9-Diaza-spiro[5.5]undecan-2-one

MDL Number

MFCD13179151

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 3,9-Diazaspiro[5.5]undecan-2-one (CAS: 867006-20-0)?

3,9-Diazaspiro[5.5]undecan-2-one (CAS: 867006-20-0) must comply with the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for hazardous material classification. In the European Union, it falls under REACH regulations. For FDA and EPA purposes, it should be assessed for safety, toxicity, and environmental impacts as per relevant guidelines.

Are there alternatives to 3,9-Diazaspiro[5.5]undecan-2-one in synthesis?

Alternatives to 3,9-Diazaspiro[5.5]undecan-2-one include similar cyclic ketones and amines. Common substitutes include 3-azabicyclo[3.3.1]nonan-2-one and other 3,9-diazaspiro compounds. Synthesis methods often involve ring-opening reactions or direct condensation of appropriate precursors.

What is the market or research trend for 3,9-Diazaspiro[5.5]undecan-2-one?

The market for 3,9-Diazaspiro[5.5]undecan-2-one is expanding in pharmaceutical and chemical research, driven by its unique chemical structure. Research trends focus on its potential as a chiral building block in asymmetric synthesis and as a precursor for natural product synthesis. Market dynamics show increasing demand from academic and industrial labs.

How should waste containing 3,9-Diazaspiro[5.5]undecan-2-one be handled?

Waste containing 3,9-Diazaspiro[5.5]undecan-2-one should be collected in a closed container and disposed of through professional waste disposal services. Incineration is a common method, but ensure it meets local air quality standards. Environmental protection precautions include minimizing waste generation and proper labeling of waste containers to comply with regulations.