D-GLUCAMINE

Base Information

• Chemical Name: D-GLUCAMINE
• CAS No.: 488-43-7
• Deprecated CAS: 61303-74-0,184167-10-0
• Molecular Formula: C6H15NO5
• Molecular Weight: 181.189
• Hs Code.: 29400090
• European Community (EC) Number: 207-677-3
• UNII: 5QN16UUF80
• DSSTox Substance ID: DTXSID901032334
• Nikkaji Number: J12.597K
• Wikidata: Q27262753
• Mol file: 488-43-7.mol

Synonyms:1-Amino-1-deoxyglucitol;Glucamine;Glucitol, 1-amino-1-deoxy-, D- (8CI);Sorbitol,1-amino-1-deoxy- (6CI);(2R,3R,4R,5S)-6-Aminohexane-1,2,3,4,5-pentol;

Chemical Property of D-GLUCAMINE

Chemical Property:

• Appearance/Colour: Crystalline solid
• Vapor Pressure: 1.78E-13mmHg at 25°C
• Melting Point: 126-128°C (dec.)
• Refractive Index: -7 ° (C=10, H2O)
• Boiling Point: 530.7 °C at 760 mmHg
• PKA: 11.96±0.35(Predicted)
• Flash Point: 274.7 °C
• PSA: 127.17000
• Density: 1.506 g/cm³
• LogP: -2.91870
• Storage Temp.: Store at 0-5°C
• Solubility.: Water (Slightly)
• XLogP3: -3.4
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 181.09502258
• Heavy Atom Count: 12
• Complexity: 123

Purity/Quality:

98%, ^*data from raw suppliers

D-Glucamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,Xi
• Hazard Codes: Xn,Xi
• Statements: 21-36/38-46-62-63
• Safety Statements: 25-26-36/37-53

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C(C(C(CO)O)O)O)O)N
• Isomeric SMILES: C([C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)N
• Uses: D-GLUCAMINE is a kind of useful ingredient for cosmetics, detergents and pharmaceutics. D-Glucamine (>75%) (cas# 488-43-7) is a compound useful in organic synthesis.

Technology Process of D-GLUCAMINE

There total 15 articles about D-GLUCAMINE 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: 77.0%

D-glucose (50-99-7) → 1-Amino-1-deoxy-D-glucitol (488-43-7)

Guidance literature:

With ammonium hydroxide; ammonium acetate; sodium cyanoborohydride; In ethanol; Reflux;

DOI:10.1039/c9ob01436e

Reference yield:

D-glucose oxime (608-81-1) → 1-Amino-1-deoxy-D-glucitol (488-43-7)

Guidance literature:

With platinum(IV) oxide; hydrogen; acetic acid; at 20 ℃; under 1810.07 - 2327.23 Torr;

DOI:10.1021/jm101338z

Reference yield:

1-Desoxy-1-nitro-D-glucitol (14199-88-3) → 1-Amino-1-deoxy-D-glucitol (488-43-7)

Guidance literature:

With water; nickel; Hydrogenation;

upstream raw materials:

1-amino-1-deoxy-D-fructose

D-glucose

1-Desoxy-1-nitro-D-glucitol

N-benzyl-1-amino-1-deoxy-D-glucitol

Downstream raw materials:

N,N-diphenylthiourea

C₆₅H₉₈N₁₆O₃₄S

C₆₇H₉₇F₃N₁₆O₃₅S

Refernces

• 1、 Beck, Daniel E.,Agama, Keli,Marchand, Christophe,Chergui, Adel,Pommier, Yves,Cushman, Mark. "Synthesis and biological evaluation of new carbohydrate-substituted indenoisoquinoline topoisomerase I inhibitors and improved syntheses of the experimental anticancer agents indotecan (LMP400) and indimitecan (LMP776)". . p. 1495 - 1512. Retrieved 2014/03/21.
• 2、 Peterson, Katherine E.,Cinelli, Maris A.,Morrell, Andrew E.,Mehta, Akhil,Dexheimer, Thomas S.,Agama, Keli,Antony, Smitha,Pommier, Yves,Cushman, Mark. "Alcohol-, diol-, and carbohydrate-substituted indenoisoquinolines as topoisomerase i inhibitors: Investigating the relationships involving stereochemistry, hydrogen bonding, and biological activity". . p. 4937 - 4953. Retrieved 2011/09/21.