1,4-Diazaspiro[5.5]undecane

Base Information

• Chemical Name: 1,4-Diazaspiro[5.5]undecane
• CAS No.: 180-76-7
• Molecular Formula: C₉H₁₈N₂
• Molecular Weight: 154.255
• Hs Code.: 2933990090
• European Community (EC) Number: 837-000-2
• DSSTox Substance ID: DTXSID70442655
• Wikidata: Q82260051
• Mol file: 180-76-7.mol

Synonyms:1,4-diazaspiro[5.5]undecane;180-76-7;SCHEMBL701053;DTXSID70442655;AKOS006281651;AB36179;1,4-Diazaspiro[5.5]undecane(8CI,9CI);EN300-91624;Z1198172533

Chemical Property of 1,4-Diazaspiro[5.5]undecane

Chemical Property:

• PSA: 24.06000
• LogP: 1.53970
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 154.146998583
• Heavy Atom Count: 11
• Complexity: 128

Purity/Quality:

98%,99%, ^*data from raw suppliers

1,4-Diazaspiro[5.5]undecane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC2(CC1)CNCCN2

Technology Process of 1,4-Diazaspiro[5.5]undecane

There total 3 articles about 1,4-Diazaspiro[5.5]undecane which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

1,4-Diaza-spiro[5.5]undec-4-ene → 1,4-diazaspiro<5.5>undecane (180-76-7)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol; under 2625.2 Torr;

DOI:10.1021/jm00022a004

Reference yield:

1-bromocyclohexanecarbaldehyde (34899-90-6) → 1,4-diazaspiro<5.5>undecane (180-76-7)

Guidance literature:

Multi-step reaction with 2 steps

1: toluene / a) RT, 1 h, 2.) reflux, 30 min

2: H₂ / 5percent Pd/C / ethanol / 2625.2 Torr

With hydrogen; palladium on activated charcoal; In ethanol; toluene;

DOI:10.1021/jm00022a004

Reference yield:

→ 1,4-diazaspiro<5.5>undecane (180-76-7)

Guidance literature:

cycl. Diamid, LiAlH4;

upstream raw materials:

1-bromocyclohexanecarbaldehyde

Refernces