5-Bromo-4-chloro-3-indolyl N-acetyl-beta-D-glucosaminide

Base Information

• Chemical Name: 5-Bromo-4-chloro-3-indolyl N-acetyl-beta-D-glucosaminide
• CAS No.: 4264-82-8
• Molecular Formula: C16H18BrClN2O6
• Molecular Weight: 449.686
• Hs Code.: 29349990
• DSSTox Substance ID: DTXSID40962618
• Nikkaji Number: J1.036.734D
• Wikidata: Q27162473
• Mol file: 4264-82-8.mol

Synonyms:4264-82-8;5-Bromo-4-chloro-3-indolyl N-acetyl-beta-D-glucosaminide;5-Bromo-4-chloro-3-indolyl-N-acetyl-beta-D-glucosaminide;N-((2S,3R,4R,5S,6R)-2-((5-Bromo-4-chloro-1H-indol-3-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)acetamide;N-[(2S,3R,4R,5S,6R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide;X-GlcNAc;5-Bromo-4-chloro-3-indoxyl-N-acetyl-beta-D-glucosaminide;MFCD00040631;SCHEMBL284856;CHEBI:90338;DTXSID40962618;AKOS015919159;s12041;AC-33217;AS-11175;B-7000;A853048;5-bromo-4-chloroindoxyl N-acetyl-beta-D-glucosaminide;Q27162473;5-bromo-4-chloro-3-indolyl n-acetyl beta-d-glucosaminide;5-Bromo-4-chloro-3-indolyl N-acetyl-beta-D-glucosamidine;5-Bromo-4-chloro-3-indolyl N-acetyl- beta -D-glucosaminide;5-Bromo-4-chloro-3-indolyl N-acetyl-beta-D-glucosaminide, >=95%;5-bromo-4-chloro-1H-indol-3-yl 2-acetamido-2-deoxy-beta-D-glucopyranoside;5-Bromo-4-chloro-3-indoxyl-2-acetamido-2-deoxy-beta-D-glucopyranoside;4-Chloro-5-bromo-1H-indole-3-yl 2-(acetylamino)-2-deoxy-beta-D-glucopyranoside;5-Bromo-4-chloro-1H-indol-3-yl 2-deoxy-2-[(1-hydroxyethylidene)amino]hexopyranoside;X-GlcNAc, 5-Bromo-4-chloro-3-indolyl 2-acetamido-2-deoxy-beta-D-glucopyranoside;N-((2S,3R,4R,5S,6R)-2-(5-bromo-4-chloro-1H-indol-3-yloxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl)acetamide

Chemical Property of 5-Bromo-4-chloro-3-indolyl N-acetyl-beta-D-glucosaminide

Chemical Property:

• Appearance/Colour: white to off-white powder
• Vapor Pressure: 1.92E-25mmHg at 25°C
• Melting Point: 240 °C(lit.)
• Refractive Index: 1.702
• Boiling Point: 777.463 °C at 760 mmHg
• PKA: 12.87±0.70(Predicted)
• Flash Point: 423.995 °C
• PSA: 124.04000
• Density: 1.786 g/cm³
• LogP: 1.29720
• Storage Temp.: −20°C
• Solubility.: DMF: soluble
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 448.00368
• Heavy Atom Count: 26
• Complexity: 517

Purity/Quality:

98%, ^*data from raw suppliers

5-Bromo-4-chloro-3-indoxyl-2-acetamido-2-deoxy-β-D-glucopyranoside ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(=O)NC1C(C(C(OC1OC2=CNC3=C2C(=C(C=C3)Br)Cl)CO)O)O
• Isomeric SMILES: CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC2=CNC3=C2C(=C(C=C3)Br)Cl)CO)O)O
• Uses: Nutrient medium for yeast culture