N-Acetyl-9-O-acetylneuraminic acid 4-aminophenylthioketoside

Base Information

Chemical Name:N-Acetyl-9-O-acetylneuraminic acid 4-aminophenylthioketoside
CAS No.:146117-12-6
Molecular Formula:C₁₉H₂₆N₂O₉S
Molecular Weight:458.489
Hs Code.:
DSSTox Substance ID:DTXSID30163273
Wikidata:Q83032157
Mol file:146117-12-6.mol

Synonyms:N-acetyl-9-O-acetylneuraminic acid 4-aminophenylthioketoside;N-acetyl-9-O-acetylneuraminic acid-alpha-p-aminophenylthioketoside;Neu5,9Ac(2)-aminophenylthioketoside;Neu5,9Ac-APTK

Suppliers and Price of N-Acetyl-9-O-acetylneuraminic acid 4-aminophenylthioketoside

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 1 raw suppliers

Chemical Property of N-Acetyl-9-O-acetylneuraminic acid 4-aminophenylthioketoside

Chemical Property:

Vapor Pressure:2.62E-30mmHg at 25°C
Boiling Point:844.5°Cat760mmHg
Flash Point:464.6°C
PSA：217.43000
Density:1.5g/cm³
LogP:0.50270
XLogP3:-0.7
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:9
Exact Mass:458.13590158
Heavy Atom Count:31
Complexity:658

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)NC1C(CC(OC1C(C(COC(=O)C)O)O)(C(=O)O)SC2=CC=C(C=C2)N)O
Isomeric SMILES:CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@@H]([C@@H](COC(=O)C)O)O)(C(=O)O)SC2=CC=C(C=C2)N)O

Technology Process of N-Acetyl-9-O-acetylneuraminic acid 4-aminophenylthioketoside

There total 10 articles about N-Acetyl-9-O-acetylneuraminic acid 4-aminophenylthioketoside 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:

: 113757-77-0
benzyl (5-acetamido-4,7,8,9-tetra-O-acetyl-2-chloro-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulpyranosid)onate

: 146117-12-6
S-(4-aminophenyl) 5-acetamido-9-O-acetyl-3,5-dideoxy-2-thio-α-D-glycero-D-galacto-2-nonulopyranosidonic acid

Guidance literature:: Multi-step reaction with 4 steps

1: 83 percent / 0.5M NaOH/H₂O / benzyltriethylammonium chloride / CHCl₃ / 0.5 h / Heating

2: methanol

3: p-toluenesulfonic acid / methyl acetate / 2 h / Ambient temperature

4: H₂ / 10percent Pd/BaSO₄ / methanol / Ambient temperature

With sodium hydroxide; water; hydrogen; toluene-4-sulfonic acid; Pd-BaSO₄; N-benzyl-N,N,N-triethylammonium chloride; In methanol; chloroform; acetic acid methyl ester;

Reference yield:

: 1849-36-1
para-nitrobenzenethiol

: 146117-12-6
S-(4-aminophenyl) 5-acetamido-9-O-acetyl-3,5-dideoxy-2-thio-α-D-glycero-D-galacto-2-nonulopyranosidonic acid

Guidance literature:: Multi-step reaction with 4 steps

1: 83 percent / 0.5M NaOH/H₂O / benzyltriethylammonium chloride / CHCl₃ / 0.5 h / Heating

2: methanol

3: p-toluenesulfonic acid / methyl acetate / 2 h / Ambient temperature

4: H₂ / 10percent Pd/BaSO₄ / methanol / Ambient temperature

With sodium hydroxide; water; hydrogen; toluene-4-sulfonic acid; Pd-BaSO₄; N-benzyl-N,N,N-triethylammonium chloride; In methanol; chloroform; acetic acid methyl ester;

Reference yield:

: 157662-10-7
benzyl onate

: 146117-12-6
S-(4-aminophenyl) 5-acetamido-9-O-acetyl-3,5-dideoxy-2-thio-α-D-glycero-D-galacto-2-nonulopyranosidonic acid

Guidance literature:: Multi-step reaction with 3 steps

1: methanol

2: p-toluenesulfonic acid / methyl acetate / 2 h / Ambient temperature

3: H₂ / 10percent Pd/BaSO₄ / methanol / Ambient temperature

With hydrogen; toluene-4-sulfonic acid; Pd-BaSO₄; In methanol; acetic acid methyl ester;