Isomaltitol

Base Information

• Chemical Name: Isomaltitol
• CAS No.: 534-73-6
• Deprecated CAS: 124569-58-0,297757-21-2,297757-21-2
• Molecular Formula: C12H24O11
• Molecular Weight: 344.316
• Hs Code.: 29400090
• European Community (EC) Number: 208-605-3
• UNII: QFA026JZX2
• DSSTox Substance ID: DTXSID3074571
• Nikkaji Number: J188.379H
• Wikipedia: Isomalt
• Wikidata: Q27287232
• RXCUI: 1363717
• Mol file: 534-73-6.mol

Synonyms:1,6-sorbitol glucopyranoside;isomaltitol

Chemical Property of Isomaltitol

Chemical Property:

• Vapor Pressure: 9.8E-29mmHg at 25°C
• Melting Point: 165.5-167 °C
• Refractive Index: 1.634
• Boiling Point: 788.5 °C at 760 mmHg
• PKA: 12.89±0.70(Predicted)
• Flash Point: 430.7 °C
• PSA: 200.53000
• Density: 1.69g/cm³
• LogP: -5.76120
• Storage Temp.: −20°C
• Solubility.: Water (Slightly)
• XLogP3: -5.2
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 8
• Exact Mass: 344.13186158
• Heavy Atom Count: 23
• Complexity: 343

Purity/Quality:

98%, ^*data from raw suppliers

Isomaltitol(Mixtureof6-O-α-D-Glucopyranosyl-D-glucitoland1-O-α-D-Glucopyranosyl-D-mannitol) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(C1C(C(C(C(O1)OCC(C(C(C(CO)O)O)O)O)O)O)O)O
• Isomeric SMILES: C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O)O)O)O
• Uses: Isomaltitol is a carbohydrate.

Technology Process of Isomaltitol

There total 14 articles about Isomaltitol 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: 100.0%

→ isomaltitol (534-73-6)

Guidance literature:

Reference yield: 93.0%

gentibiose (536-11-8,645-03-4,902-54-5,3031-35-4,4604-26-6,5340-95-4,5995-99-3,5996-00-9,13299-20-2,13299-21-3,15548-40-0,16750-26-8,16967-97-8,23339-29-9,24822-33-1,33428-65-8,34674-94-7,35867-21-1,37169-69-0,37169-72-5,38533-27-6,50271-70-0,65207-30-9,82729-73-5,95463-59-5,100427-99-4,100430-37-3,100483-14-5,102572-70-3,110658-40-7,123809-47-2,140461-60-5,143615-15-0) → (S)-6-((2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-hexane-1,2,3,4,5-pentaol (497-83-6,534-73-6,20942-96-5,20942-99-8,28971-30-4,31282-09-4,31657-06-4,75828-92-1,75828-93-2,86195-30-4,97133-51-2,104831-98-3)

Guidance literature:

With lithium; In ethylenediamine; for 1h; Product distribution; further disaccharides investigated;

DOI:10.1016/0008-6215(87)80028-9

Reference yield: 85.0%

→ isomaltitol (534-73-6) + isomaltose (499-40-1)

Guidance literature:

upstream raw materials:

isomaltose

D-sorbitol

Sucrose

nickel

Downstream raw materials:

D-sorbitol

D-glucose

Refernces

• 1、 Tindall, Daniel J.,Mader, Steffen,Kindler, Alois,Rominger, Frank,Hashmi, A. Stephen K.,Schaub, Thomas. "Selective and Scalable Synthesis of Sugar Alcohols by Homogeneous Asymmetric Hydrogenation of Unprotected Ketoses". supporting information. p. 721 - 725. Retrieved 2020/10/19.
• 2、 -. "PROCESSES FOR PRODUCING ISOMALTOSE AND ISOMALTITOL AND USE THEREOF". . . Retrieved 2008/06/13.