Spiro[4.5]decane-8-carboxylic acid

Base Information

• Chemical Name: Spiro[4.5]decane-8-carboxylic acid
• CAS No.: 19027-23-7
• Molecular Formula: C11H18O2
• Molecular Weight: 182.25900
• European Community (EC) Number: 852-796-1
• DSSTox Substance ID: DTXSID10552702
• Wikidata: Q82433069
• Mol file: 19027-23-7.mol

Synonyms:Spiro[4.5]decane-8-carboxylic acid;19027-23-7;SCHEMBL8810863;DTXSID10552702;CS-0108561;D76817;EN300-186912

Chemical Property of Spiro[4.5]decane-8-carboxylic acid

Chemical Property:

• PSA: 37.30000
• LogP: 2.82160
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 182.130679813
• Heavy Atom Count: 13
• Complexity: 194

Purity/Quality:

97% ^*data from raw suppliers

Spiro[4.5]decane-8-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC2(C1)CCC(CC2)C(=O)O

Technology Process of Spiro[4.5]decane-8-carboxylic acid

There total 4 articles about Spiro[4.5]decane-8-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:

1,1-bis-(β-bromoethyl)-cyclopentane (3187-39-1) → Spiro[4.5]decane-8-carboxylic acid (19027-23-7)

Guidance literature:

Multi-step reaction with 3 steps

1: (i) NaOEt, EtOH, (ii) /BRN= 1903054/

2: KOH / ethanol

3: (heating)

With potassium hydroxide; In ethanol;

DOI:10.1021/jm00275a028

Reference yield:

Spiro[4.5]decane-8,8-dicarboxylic acid diethyl ester (19027-21-5) → Spiro[4.5]decane-8-carboxylic acid (19027-23-7)

Guidance literature:

Multi-step reaction with 2 steps

1: KOH / ethanol

2: (heating)

With potassium hydroxide; In ethanol;

DOI:10.1021/jm00275a028

Reference yield:

Spiro[4.5]decane-8,8-dicarboxylic acid (19027-22-6) → Spiro[4.5]decane-8-carboxylic acid (19027-23-7)

Guidance literature:

(heating);

DOI:10.1021/jm00275a028

upstream raw materials:

Spiro[4.5]decane-8,8-dicarboxylic acid

1,1-bis-(β-bromoethyl)-cyclopentane

Spiro[4.5]decane-8,8-dicarboxylic acid diethyl ester

Downstream raw materials:

Benzenesulfonic acid 2-oxo-2-spiro[4.5]dec-8-yl-ethyl ester