6-Bromo-2-naphthyl beta-D-glucopyranosiduronic acid

Base Information

• Chemical Name: 6-Bromo-2-naphthyl beta-D-glucopyranosiduronic acid
• CAS No.: 22720-35-0
• Molecular Formula: C16H15 Br O7
• Molecular Weight: 399.195
• Hs Code.: 29389090
• European Community (EC) Number: 245-176-1
• DSSTox Substance ID: DTXSID70945398
• Nikkaji Number: J208.062A
• Wikidata: Q72448302
• Mol file: 22720-35-0.mol

Synonyms:22720-35-0;6-BROMO-2-NAPHTHYL-BETA-D-GLUCURONIDE;6-Bromo-2-naphthyl beta-D-glucopyranosiduronic acid;6-Bromo-2-naphthyl beta-D-glucuronide;EINECS 245-176-1;(2S,3S,4S,5R,6S)-6-(6-bromonaphthalen-2-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid;(2S,3S,4S,5R,6S)-6-((6-Bromonaphthalen-2-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid;C16H15BrO7;6-bromo-2-naphthyl-beta-d-glucuronic acid;SCHEMBL963208;C16-H15-Br-O7;DTXSID70945398;MFCD00046453;6-Bromo-2-naphthyl beta -D-glucuronide;AS-11181;6-bromonaphthalen-2-yl hexopyranosiduronic acid;(2S,3S,4S,5R,6S)-6-((6-Bromonaphthalen-2-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylicacid;(2S,3S,4S,5R,6S)-6-(6-bromonaphthalen-2-yloxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid;(2S,3S,4S,5R,6S)-6-[(6-bromonaphthalen-2-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Chemical Property of 6-Bromo-2-naphthyl beta-D-glucopyranosiduronic acid

Chemical Property:

• Vapor Pressure: 1.97E-18mmHg at 25°C
• Boiling Point: 662.1oC at 760mmHg
• PKA: 2.77±0.70(Predicted)
• Flash Point: 354.2oC
• PSA: 116.45000
• Density: 1.81 g/cm3
• LogP: 0.87330
• Storage Temp.: −20°C
• XLogP3: 2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 398.00012
• Heavy Atom Count: 24
• Complexity: 462

Purity/Quality:

98% ^*data from raw suppliers

6-Bromo-2-naphthyl b-D-glucuronide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=CC(=C2)Br)C=C1OC3C(C(C(C(O3)C(=O)O)O)O)O
• Isomeric SMILES: C1=CC2=C(C=CC(=C2)Br)C=C1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O

Technology Process of 6-Bromo-2-naphthyl beta-D-glucopyranosiduronic acid

There total 1 articles about 6-Bromo-2-naphthyl beta-D-glucopyranosiduronic 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:

6-brom-2-naphthyl-O-β-D-glucopyranoside (15548-61-5) → 6-bromo-2-naphthyl glucuronide (22720-35-0)

Guidance literature:

With water; oxygen; platinum; at 90 - 100 ℃;

upstream raw materials:

6-brom-2-naphthyl-O-β-D-glucopyranoside