Glucoheptonic acid

Base Information

• Chemical Name: Glucoheptonic acid
• CAS No.: 87-74-1
• Molecular Formula: C7H14 O8
• Molecular Weight: 226.183
• European Community (EC) Number: 201-769-7
• UNII: B1F50160Z2
• DSSTox Substance ID: DTXSID3048077
• Nikkaji Number: J21.227J
• Wikidata: Q27135733
• NCI Thesaurus Code: C174626
• Metabolomics Workbench ID: 65018
• Mol file: 87-74-1.mol

Synonyms:alpha-glucoheptonic acid;alpha-glucoheptonic acid, calcium salt (2:1);alpha-glucoheptonic acid, calcium salt (2:1), heptahydrate;alpha-glucoheptonic acid, magnesium salt (2:1);alpha-glucoheptonic acid, potassium salt;alpha-glucoheptonic acid, sodium salt;calcium gluceptate;calcium glucoheptonate;copper glucoheptonate;glucoheptonate;glucoheptonic acid

Chemical Property of Glucoheptonic acid

Chemical Property:

• Vapor Pressure: 1.87E-24mmHg at 25°C
• Melting Point: 145-148°
• Boiling Point: 727.8°C at 760 mmHg
• Flash Point: 407.9°C
• PSA: 158.68000
• Density: 1.8g/cm³
• LogP: -4.13220
• XLogP3: -4
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 6
• Exact Mass: 226.06886740
• Heavy Atom Count: 15
• Complexity: 207

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C(C(C(C(C(=O)O)O)O)O)O)O)O
• Isomeric SMILES: C([C@H]([C@H]([C@@H]([C@H]([C@H](C(=O)O)O)O)O)O)O)O

Technology Process of Glucoheptonic acid

There total 17 articles about Glucoheptonic acid 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:

hydrogen cyanide (74-90-8) + D-glucose (50-99-7) → D-glucoheptonic acid (87-74-1)

Guidance literature:

With water; at 25 ℃;

Reference yield:

→ D-glucoheptonic acid (87-74-1)

Guidance literature:

With pyridine; water; at 140 ℃;

Reference yield:

D-glucose (50-99-7) → D-glucoheptonic acid (87-74-1)

Guidance literature:

upstream raw materials:

hydrogen cyanide

D-glucose

glucose

D-glycero-D-gulo-heptose

Downstream raw materials:

D-(1R)-1-(1H-benzimidazol-2-yl)-galactitol

3-Desoxy-D-threo-pentonsaeure

D-glycero-D-gulo-heptose

oenanthic acid