D-Iditol

Base Information

• Chemical Name: D-Iditol
• CAS No.: 25878-23-3
• Molecular Formula: C6H14O6
• Molecular Weight: 182.174
• Hs Code.: 29400090
• European Community (EC) Number: 232-598-6,246-314-3
• NSC Number: 755896
• UNII: 82FOM4R7CD,BP8KW73WMG
• DSSTox Substance ID: DTXSID701336594,DTXSID401336595
• Nikkaji Number: J92.812G
• Wikipedia: Iditol
• Wikidata: Q5989072
• Metabolomics Workbench ID: 50923
• Mol file: 25878-23-3.mol

Synonyms:iditol;L-iditol

Chemical Property of D-Iditol

Chemical Property:

• Melting Point: 76 °C
• Refractive Index: 3 ° (C=1, H2O)
• Boiling Point: 494.9 °C at 760 mmHg
• PKA: 13.14±0.20(Predicted)
• Flash Point: 292.5 °C
• PSA: 121.38000
• Density: 1.596 g/cm³
• LogP: -3.58540
• Water Solubility.: Soluble in water
• XLogP3: -3.1
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 182.07903816
• Heavy Atom Count: 12
• Complexity: 105

Purity/Quality:

98%, ^*data from raw suppliers

D-Iditol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: UVCB,Other Classes -> Alcohols and Polyols,Other
• Canonical SMILES: C(C(C(C(C(CO)O)O)O)O)O
• Isomeric SMILES: C([C@H]([C@@H]([C@H]([C@@H](CO)O)O)O)O)O
• Recent ClinicalTrials: Comparison of Fibrinogen Concentrate and Cryoprecipitate in Pediatric Cardiac Surgery Patients
• Recent EU Clinical Trials: A multicenter, randomized, double-blind, placebo-controlled, parallel, phase 3 study to assess the efficacy and safety of fibrinogen concentrate (FGTW) in the management of bleeding in patients undergoing complex cardiac surgery (involving CPB)
• Uses: D-iditol is a sugar alcohol that accumulates in galactokinase deficiency.

Technology Process of D-Iditol

There total 61 articles about D-Iditol 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: 63.2%

cellulose (9004-34-6) → propylene glycol (57-55-6,63625-56-9) + ethylene glycol (107-21-1) + isopropyl alcohol (67-63-0,8013-70-5) + sorbitol (50-70-4,69-65-8,87-78-5,133-43-7,488-44-8,488-45-9,608-66-2,643-01-6,643-03-8,5552-13-6,6706-59-8,24557-79-7,25878-23-3,26566-34-7,45007-61-2,60660-56-2,60660-57-3,60660-58-4,132747-27-4)

Guidance literature:

With water; at 220 ℃; for 0.5h; under 52505.3 Torr; Temperature; Pressure;

Reference yield: 33.6%

cellulose (9004-34-6) → propylene glycol (57-55-6,63625-56-9) + isopropyl alcohol (67-63-0,8013-70-5) + sorbitol (50-70-4,69-65-8,87-78-5,133-43-7,488-44-8,488-45-9,608-66-2,643-01-6,643-03-8,5552-13-6,6706-59-8,24557-79-7,25878-23-3,26566-34-7,45007-61-2,60660-56-2,60660-57-3,60660-58-4,132747-27-4)

Guidance literature:

With water; at 220 ℃; for 0.5h; under 45004.5 Torr; Temperature; Pressure;

Reference yield: 15.8%

cellulose (9004-34-6) → propylene glycol (57-55-6,63625-56-9) + sorbitol (50-70-4,69-65-8,87-78-5,133-43-7,488-44-8,488-45-9,608-66-2,643-01-6,643-03-8,5552-13-6,6706-59-8,24557-79-7,25878-23-3,26566-34-7,45007-61-2,60660-56-2,60660-57-3,60660-58-4,132747-27-4)

Guidance literature:

With hydrogen; In water; at 239.84 ℃; for 4h; under 30003 Torr;

DOI:10.1039/c2gc35685f

upstream raw materials:

L-sorbose

glucose

D-idose

(2S,3E,5S)-1,6-bis(trityloxy)hex-3-ene-2,5-diol

Downstream raw materials:

DL-glucitol hexa-acetate

O¹,O³;O²,O⁴;O⁵,O⁶-trimethanediyl-DL-glucitol

L-iditol hexaacetate

propylene glycol

Refernces

• 1、 Guo, Jiaxing,He, Minyao,Li, Cuiqing,Liu, ShanShan,Song, Yongji,Wang, Hong,Wang, Xincheng. "Direct conversion of cellulose into isosorbide over Ni doped NbOPO4catalysts in water". supporting information. p. 10292 - 10299. Retrieved 2020/07/14.
• 2、 Yazdani, Parviz,Wang, Bo,Gao, Feng,Kawi, Sibudjing,Borgna, Armando. "Role of the Strong Lewis Base Sites on Glucose Hydrogenolysis". . p. 3845 - 3853. Retrieved 2018/07/31.