2-Acetamido-3,4,6-tri-O-acetyl-2-deoxy-β-D-glucopyranosyl Azide - ≥98%(HPLC) , CAS No.6205-69-2

CAS: 6205-69-2 Cat. No.: A151074 Molecular Weight: 372.33 Beilstein Registry Number: 18(5)10,575 PubChem CID: 2725015

GRADE & PURITY ≥98%(HPLC)

Synonyms

2-Acetamido-2-deoxy-b-D-glucopyranosyl azide 3,4,6-triacetate | AKOS040768954 | RMCFMPMNMQZHSF-DHGKCCLASA-N | 2-Acetamido-2-deoxy-3,4,6-tri-O-acetyl-beta-D-glucopyranosyl azide | MFCD00216968 | 2-Acetamido-3,4,6-tri-O-acetyl-2-deoxy-beta-D-glucopyranosyl

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

2-Acetamido-2-deoxy-b-D-glucopyranosyl azide 3, 4, 6-triacetate | AKOS040768954 | RMCFMPMNMQZHSF-DHGKCCLASA-N | 2-Acetamido-2-deoxy-3, 4, 6-tri-O-acetyl-beta-D-glucopyranosyl azide | MFCD00216968 | 2-Acetamido-3, 4, 6-tri-O-acetyl-2-deoxy-beta-D-glucopyranosyl

Specifications & Purity

≥98%(HPLC)

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%(HPLC)

Names and Identifiers

• Pubchem Sid: 504760941
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504760941
• Canonical Smiles: CC(=O)NC1C(C(C(OC1N=[N+]=[N-])COC(=O)C)OC(=O)C)OC(=O)C
• IUPAC Name: [(2R,3S,4R,5R,6R)-5-acetamido-3,4-diacetyloxy-6-azidooxan-2-yl]methyl acetate
• InChIKey: RMCFMPMNMQZHSF-DHGKCCLASA-N
• INCHI: 1S/C14H20N4O8/c1-6(19)16-11-13(25-9(4)22)12(24-8(3)21)10(5-23-7(2)20)26-14(11)17-18-15/h10-14H,5H2,1-4H3,(H,16,19)/t10-,11-,12-,13-,14-/m1/s1
• Isomeric SMILES: CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1N=[N+]=[N-])COC(=O)C)OC(=O)C)OC(=O)C
• WGK Germany: 3
• PubChem CID: 2725015
• Molecular Weight: 372.33
• Beilstein: 18(5)10,575
• Reaxy-Rn: 60288

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Tricarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Tricarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Tricarboxylic acids and derivatives
• Alternative Parents: Oxanes Monosaccharides Acetamides Secondary carboxylic acid amides Carboxylic acid esters Azo imides Azo compounds Oxacyclic compounds Organopnictogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Tricarboxylic acid or derivatives - Monosaccharide - Oxane - Acetamide - Azo compound - Azo imide - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Organoheterocyclic compound - Oxacycle - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organic zwitterion - Organic oxide - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: heat sensitive；Moisture sensitive
• Melt Point(°C): 167°C(dec.)(lit.)
• Molecular Weight: 372.330 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 9
• Exact Mass: 372.128 Da
• Monoisotopic Mass: 372.128 Da
• Topological Polar Surface Area: 132.000 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 618.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 5
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 1
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1