cis-1,2-Cyclododecanediol

Base Information

• Chemical Name: cis-1,2-Cyclododecanediol
• CAS No.: 4422-05-3
• Molecular Formula: C12H24O2
• Molecular Weight: 200.321
• European Community (EC) Number: 636-948-2
• DSSTox Substance ID: DTXSID501015996
• Nikkaji Number: J208.185G
• Mol file: 4422-05-3.mol

Synonyms:cis-1,2-Cyclododecanediol;(1R,2S)-cyclododecane-1,2-diol;1,2-Cyclododecanediol #;SCHEMBL7515202;HAMFVYJFVXTJCJ-TXEJJXNPSA-N;DTXSID501015996;AKOS015911081;4422-05-3

Chemical Property of cis-1,2-Cyclododecanediol

Chemical Property:

• PSA: 40.46000
• LogP: 2.62280
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 200.177630004
• Heavy Atom Count: 14
• Complexity: 120

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CCCCCC(C(CCCC1)O)O
• Isomeric SMILES: C1CCCCC[C@@H]([C@@H](CCCC1)O)O

Technology Process of cis-1,2-Cyclododecanediol

There total 5 articles about cis-1,2-Cyclododecanediol 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:

dodecanedial (38279-34-4) → cis-1,2-cyclododecanediol (4422-05-3) + cis-1,2-cyclododecanediol (4422-05-3,5202-26-6,15199-41-4,118101-28-3,118101-30-7,118101-31-8)

Guidance literature:

With TiCl₃(DME)2; copper; zinc; In 1,2-dimethoxyethane; at 25 ℃; for 38h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1016/S0040-4039(00)72707-9

Reference yield:

dodecanedial (38279-34-4) → cis-1,2-cyclododecanediol (4422-05-3) + cis-1,2-cyclododecanediol (4422-05-3,5202-26-6,15199-41-4,118101-28-3,118101-30-7,118101-31-8)

Guidance literature:

With TiCl₃(DME)2; copper; zinc; In 1,2-dimethoxyethane; at 25 ℃; for 38h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1016/S0040-4039(00)72707-9

Reference yield:

→ cis-1,2-cyclododecanediol (4422-05-3,5202-26-6,15199-41-4,118101-28-3,118101-30-7,118101-31-8)

Guidance literature:

With pyridine; osmium(VIII) oxide;

DOI:10.1002/hlca.19550380715

upstream raw materials:

dodecanedial

formic acid

cis-cyclododecene

dihydrogen peroxide

Downstream raw materials:

12-oxododecanoic acid

1,12-dodecanedioic acid

dodecanedial

cyclododecane-1,2-dione

Refernces