3-(Tert-butoxycarbonyl)-3-azaspiro[5.5]undecane-9-carboxylic acid

Base Information

• Chemical Name: 3-(Tert-butoxycarbonyl)-3-azaspiro[5.5]undecane-9-carboxylic acid
• CAS No.: 170228-81-6
• Molecular Formula: C16H27NO4
• Molecular Weight: 297.39000
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID40570292
• Wikidata: Q82457683
• Mol file: 170228-81-6.mol

Synonyms:170228-81-6;3-(tert-butoxycarbonyl)-3-azaspiro[5.5]undecane-9-carboxylic acid;3-AZASPIRO[5.5]UNDECANE-3,9-DICARBOXYLIC ACID 3-(TERT-BUTYL) ESTER;3-Aza-spiro[5.5]undecane-3,9-dicarboxylic acid 3-tert-butyl ester;3-[(2-methylpropan-2-yl)oxycarbonyl]-3-azaspiro[5.5]undecane-9-carboxylic acid;3-BOC--3-AZASPIRO[5.5]UNDECANE-9-CARBOXYLIC ACID;MFCD11042915;3-[(tert-butoxy)carbonyl]-3-azaspiro[5.5]undecane-9-carboxylic acid;3-BOC-3-AZASPIRO[5.5]UNDECANE-9-CARBOXYLIC ACID;3-Azaspiro[5.5]undecane-3,9-dicarboxylicacid 3-(tert-butyl) ester;SCHEMBL484799;DTXSID40570292;ZDWMIWSOZZMELY-UHFFFAOYSA-N;3-(tert-Butoxycarbonyl)-3-azaspiro[5.5]undecane-9-carboxylicacid;9-tert-Butoxycarbonyl-9-azaspiro[5.5]undecane-3-carboxylic acid;VGA22881;AKOS015950450;PB22451;AS-35695;SY098646;CS-0051575;EN300-359101;A852871;W-206002;3-Azaspiro[5.5]undecane-3,9-dicarboxylic acid 3-(tert-butyl)ester 95+%;Not available

Chemical Property of 3-(Tert-butoxycarbonyl)-3-azaspiro[5.5]undecane-9-carboxylic acid

Chemical Property:

• Boiling Point: 435.3±45.0 °C(Predicted)
• PKA: 4.75±0.20(Predicted)
• PSA: 66.84000
• Density: 1.14±0.1 g/cm3(Predicted)
• LogP: 3.21640
• Storage Temp.: 2-8°C
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 297.19400834
• Heavy Atom Count: 21
• Complexity: 395

Purity/Quality:

97% ^*data from raw suppliers

3-Azaspiro[5.5]undecane-3,9-dicarboxylicacid3-(tert-butyl)ester 97.0% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCC2(CCC(CC2)C(=O)O)CC1

Technology Process of 3-(Tert-butoxycarbonyl)-3-azaspiro[5.5]undecane-9-carboxylic acid

There total 2 articles about 3-(Tert-butoxycarbonyl)-3-azaspiro[5.5]undecane-9-carboxylic acid 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: 90.0%

→ (+)-N-[(3R)-2,3-dihydro-1-methyl-2-oxo-5-phenyl-1H-1,4-benzo-diazepin-3-yl]-1'-(1,1-dimethylethoxycarbonyl)spiro(cyclohexan-4,4'-piperidine)-1-carboxamide (170228-43-0) + 3-t-Butyloxycarbonyl-3-azaspiro[5.5]undecane-9-carboxylic acid (170228-81-6)

Guidance literature:

Reference yield:

→ 3-t-Butyloxycarbonyl-3-azaspiro[5.5]undecane-9-carboxylic acid (170228-81-6)

Guidance literature:

Reference yield:

(S)-tert-butyl 4-(1,2,3,4-tetrahydroisoquinoline-1-carboxamido)benzoate trifluoroacetate + 3-t-Butyloxycarbonyl-3-azaspiro[5.5]undecane-9-carboxylic acid (170228-81-6) → C33H41N3O6

Guidance literature:

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; for 24h;

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