Chitotetraose tetrahydrochloride hydrate

Basic Information

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CAS Number

117399-50-5

Molecular Formula

C24H47ClN4O17

Molecular Weight

699.1 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Polymers and Plastics Thermoplastics Polyolefins

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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OC[C@H]([C@H]([C@@H]([C@H](C=O)N)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1N)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1N)O)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1N)O)O)O.Cl

InChI

InChI=1S/C24H46N4O17.ClH/c25-6(1-29)14(35)19(7(34)2-30)43-23-12(27)17(38)21(9(4-32)41-23)45-24-13(28)18(39)20(10(5-33)42-24)44-22-11(26)16(37)15(36)8(3-31)40-22;/h1,6-24,30-39H,2-5,25-28H2;1H/t6-,7+,8+,9+,10+,11+,12+,13+,14+,15+,16+,17+,18+,19+,20+,21+,22-,23-,24-;/m0./s1

InChIKey

TWEYQBIEOMWMHH-GEKXSUFZSA-N

LogP

-9.618800000000016

Topological Polar Surface Area

378.83000000000004 Å²

Hydrogen Bond Donor/Acceptor

18 / 21

Complexity

933

Synonyms & References

English

Chitotetraose Tetrahydrochloride Hydrate
(3S,5S,6S)-5-amino-6-[(3S,5S,6S)-5-amino-6-[(3S,5S,6S)-5-amino-6-[(3S,5S,6R)-5-amino-4,6-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-2-(hydroxymethyl)oxane-3,4-diol,tetrahydroc
Chitosan Tetramer Hydrate
Chitotetraose Tetrahydrochloride
O-2-Amino-2-deoxy-beta-D-glucopyranosyl-(1-4)-O-2-amino-2-deoxy-beta-D-glucopyranosyl-(1-4)-O-2-amino-2-deoxy-beta-D-glucopyranosyl-(1-4)-2-amino-2-deoxy-D-glucose tetrahydrochloride
Chitosan Tetramer
2-Amino-2-deoxy-beta-D-threo-hexopyranosyl-(1->4)-2-amino-2-deoxy-beta-D-threo-hexopyranosyl-(1->4)-2-amino-2-deoxy-beta-D-threo-hexopyranosyl-(1->4)-2-amino-2-deoxy-beta-D-threo-hexopyranose--hydrogen chloride (1/4)
(3S,5S,6S)-5-Amino-6-[(3S,5S,6S)-5-amino-6-[(3S,5S,6S)-5-amino-6-[(3S,5S,6R)-5-amino-4,6-dihydroxy-2
Chitotetraose tetrahydrochloride

MDL Number

MFCD00210266

FAQ

What are the physical and chemical properties of Chitotetraose tetrahydrochloride hydrate (CAS: 117399-50-5)?

Chitotetraose tetrahydrochloride hydrate is a crystalline compound with a molecular weight of approximately 863.4 g/mol. It has a solubility of about 10 g/L in water at 20°C. Chemically, it is relatively stable but reacts with bases to form the corresponding salt. It is highly soluble in water and less soluble in organic solvents.

How is Chitotetraose tetrahydrochloride hydrate (CAS: 117399-50-5) typically synthesized?

Chitotetraose tetrahydrochloride hydrate is typically synthesized through the hydrolysis of chitin, followed by the reaction with hydrochloric acid. The process involves the use of strong acids and bases, with yield and selectivity varying based on reaction conditions. The exact method may involve the use of catalysts to enhance reaction selectivity and yield.

What industries use Chitotetraose tetrahydrochloride hydrate (CAS: 117399-50-5)?

Chitotetraose tetrahydrochloride hydrate is used in various industries, including pharmaceuticals for its potential as a bioactive compound, in the production of polymers for its structural properties, and in the development of sensors and semiconductors due to its unique chemical properties.

What precautions should be taken when handling Chitotetraose tetrahydrochloride hydrate (CAS: 117399-50-5)?

When handling Chitotetraose tetrahydrochloride hydrate, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or fume hood to avoid inhalation. Spills should be cleaned up using appropriate absorbent materials and handled according to the safety data sheet (SDS) guidelines.