Sorbitan

Base Information

• Chemical Name: Sorbitan
• CAS No.: 12441-09-7
• Deprecated CAS: 27838-83-1,50975-62-7,1417403-40-7,40825-92-1,2109-61-7
• Molecular Formula: C₆H₁₄O₆*OPb
• Molecular Weight: 405.373
• European Community (EC) Number: 248-391-9,235-671-0,309-491-9
• UNII: AV0YTZ4E6J
• DSSTox Substance ID: DTXSID20893390,DTXSID50893383
• Nikkaji Number: J17.068B
• Wikipedia: Sorbitan
• Wikidata: Q59951142
• NCI Thesaurus Code: C75651,C83509
• RXCUI: 1307571,1367146
• Metabolomics Workbench ID: 154883
• Mol file: 12441-09-7.mol

Synonyms:1,4-Anhydro-D-glucitol;27299-12-3;Sorbitan;1,4-Sorbitan;1,4-Anhydro-D-sorbitol;100402-56-0;UNII-AV0YTZ4E6J;AV0YTZ4E6J;UNII-6O92ICV9RU;(2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol;EINECS 235-671-0;EINECS 248-391-9;EINECS 309-491-9;1,4-Anhydroglucitol;d-Glucose, ether with 1,4-anhydro-d-glucitol;D-Glucitol, anhydro-;1,4-anhydrosorbitol;Arlitan;SCHEMBL1386;6O92ICV9RU;D-Glucitol, 1,4-anhydro-;DTXSID20893390;DTXSID50893383;1,4-SORBITAN [USP-RS];JNYAEWCLZODPBN-JGWLITMVSA-N;AKOS006274480;AT36238;DB14474;CS-0208700;W-202151;Q59951142;(2R,3R,4S)-2-((R)-1,2-Dihydroxyethyl)tetrahydrofuran-3,4-diol;28218-56-6

Chemical Property of Sorbitan

Chemical Property:

• Vapor Pressure: 5.87E-06mmHg at 25°C
• Melting Point: 113 °C(Solv: ethyl acetate (141-78-6); ethanol (64-17-5))
• Refractive Index: 1.607
• Boiling Point: 442.5°Cat760mmHg
• Flash Point: 221.4°C
• PSA: 90.15000
• Density: 1.573g/cm³
• LogP: -2.53980
• XLogP3: -2.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 164.06847348
• Heavy Atom Count: 11
• Complexity: 128

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(C(O1)C(CO)O)O)O
• Isomeric SMILES: C1[C@@H]([C@H]([C@H](O1)[C@@H](CO)O)O)O

Technology Process of Sorbitan

There total 3 articles about Sorbitan 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:

D-galactitol (608-66-2) + lead(IV) tetraacetate (546-67-8) → galactitol; dulcitol (12441-09-7,31870-11-8,34559-08-5,34828-64-3,40854-78-2,132879-30-2)

Guidance literature:

With ammoniacal;

Reference yield:

D-galactitol (608-66-2) → galactitol; dulcitol (12441-09-7,31870-11-8,34559-08-5,34828-64-3,40854-78-2,132879-30-2)

Guidance literature:

With copper(I) sulfate;

Reference yield:

mannitol (69-65-8) → D-mannitol; compound with calcium oxide (12441-09-7,31870-11-8,34559-08-5,34828-64-3,40854-78-2,132879-30-2)

Guidance literature:

With calcium hydroxide; ethanol; water;

upstream raw materials:

D-galactitol

lead(IV) tetraacetate

mannitol