Chitosan - ≥75%(deacetylated) , CAS No.9012-76-4

CAS: 9012-76-4 Cat. No.: C299272 Formula: (C₆H₁₁NO₄)n Numero EC: 618-480-0

GRADE & PURITY ≥75%(deacetylated)

Synonyms

Kytex M | Toluene, o-chloro- | Chitopearl BCW 3505 | Chitopearl BCW 2500 | YEA | Toluene, o-bromo- | AKOS037652919 | Chitopearl BCW 3507 | Chitosan | Sea Cure F | Q408510 | AKOS015918343

Storage

Room temperature

Shipped In

Normal

Panoramica

Forms gels with multivalent anions. Gives clear solutions that dry to strong, clear films.
Shrimp shell derived chitosan, deacetylated chitin (poly β-1,4-D-glucosamine), may be used as a biocompatible, antibacterial and environmentally friendly polyelectrolyte biomaterial with a variety of applications including uses in water treatment, chromatography, additives for cosmetics, textile treatment for antimicrobial activity, novel fibers for textiles, photographic papers, biodegradable films, biomedical devices, and microcapsule implants for controlled release in drug delivery. It may be derivatized to further expand its uses.

Specifications

Sinonimi

Kytex M | Toluene, o-chloro- | Chitopearl BCW 3505 | Chitopearl BCW 2500 | YEA | Toluene, o-bromo- | AKOS037652919 | Chitopearl BCW 3507 | Chitosan | Sea Cure F | Q408510 | AKOS015918343

Specifiche e purezza

≥75%(deacetylated)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥75%(deacetylated)

Nomi e identificatori

• Pubchem Sid: 508813173
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/508813173
• IUPAC Name: methyl N-[(2S,3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-amino-5-[(2S,3R,4R,5S,6R)-3-amino-5-[(2S,3R,4R,5S,6R)-3-amino-5-[(2S,3R,4R,5S,6R)-3-amino-5-[(2S,3R,4R,5S,6R)-3-amino-5-[(2S,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[(2R,3S,4R,5R,6S)-5-amino-6-[(2R,3S,4R,5R,6R)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-3-yl]carbamate
• InChIKey: FLASNYPZGWUPSU-SICDJOISSA-N
• INCHI: 1S/C56H103N9O39/c1-87-56(86)65-28-38(84)46(19(10-74)96-55(28)104-45-18(9-73)95-49(27(64)37(45)83)97-39-12(3-67)88-47(85)20(57)31(39)77)103-54-26(63)36(82)44(17(8-72)94-54)102-53-25(62)35(81)43(16(7-71)93-53)101-52-24(61)34(80)42(15(6-70)92-52)100-51-23(60)33(79)41(14(5-69)91-51)99-50-22(59)32(78)40(13(4-68)90-50)98-48-21(58)30(76)29(75)11(2-66)89-48/h11-55,66-85H,2-10,57-64H2,1H3,(H,65,86)/t11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48+,49+,50+,51+,52+,53+,54+,55+/m1/s1
• Isomeri SMILES: COC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)N)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)N)O)CO)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)N)O)N)O)N)O)N)O)N)O)N)O

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Oligosaccharides
• Alternative Parents: Aminoglycosides O-glycosyl compounds Oxanes Methylcarbamates 1,2-aminoalcohols Secondary alcohols Hemiacetals Organic carbonic acids and derivatives Acetals Oxacyclic compounds Monoalkylamines Primary alcohols Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oligosaccharide - Aminoglycoside core - Glycosyl compound - O-glycosyl compound - Amino saccharide - Oxane - Methylcarbamate - Carbamic acid ester - 1,2-aminoalcohol - Secondary alcohol - Hemiacetal - Carbonic acid derivative - Acetal - Oxacycle - Organoheterocyclic compound - Organic nitrogen compound - Organonitrogen compound - Primary alcohol - Primary aliphatic amine - Primary amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Alcohol - Organopnictogen compound - Aliphatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as oligosaccharides. These are carbohydrates made up of 3 to 10 monosaccharide units linked to each other through glycosidic bonds.
• 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

Proprietà chimiche e fisiche

• Punto di fusione (°C): 102.5°C
• Peso molecolare: 1526.500 g/mol
• XLogP3: -21.400
• Hydrogen Bond Donor Count: 29
• Hydrogen Bond Acceptor Count: 47
• Rotatable Bond Count: 27
• Exact Mass: 1525.64 Da
• Monoisotopic Mass: 1525.64 Da
• Topological Polar Surface Area: 808.000 Ų
• Heavy Atom Count: 104
• Formal Charge: 0
• Complexity: 2630.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 45
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1