Sucrose 1'-benzoate

Base Information

Chemical Name:Sucrose 1'-benzoate
CAS No.:123499-67-2
Molecular Formula:C₁₉H₂₆O₁₂
Molecular Weight:446.408
Hs Code.:
UNII:0QJ4142GDD
Nikkaji Number:J1.234.398A
Wikidata:Q27237108

Synonyms:1'-o-Benzoylsucrose;Sucrose 1'-benzoate;1'-o-Benzoylsucrose, (+)-;UNII-0QJ4142GDD;0QJ4142GDD;123499-67-2;alpha-D-Glucopyranoside, 1-o-benzoyl-beta-D-fructofuranosyl;((2S,3S,4S,5R)-3,4-Dihydroxy-5-(hydroxymethyl)-2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydrofuran-2-yl)methyl benzoate;SCHEMBL237199;Q27237108;.ALPHA.-D-GLUCOPYRANOSIDE, 1-O-BENZOYL-.BETA.-D-FRUCTOFURANOSYL

Suppliers and Price of Sucrose 1'-benzoate

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
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price

Total 0 raw suppliers

Chemical Property of Sucrose 1'-benzoate

Chemical Property:

XLogP3:-2
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:8
Exact Mass:446.14242626
Heavy Atom Count:31
Complexity:598

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(=O)OCC2(C(C(C(O2)CO)O)O)OC3C(C(C(C(O3)CO)O)O)O
Isomeric SMILES:C1=CC=C(C=C1)C(=O)OC[C@@]2([C@H]([C@@H]([C@H](O2)CO)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O

Technology Process of Sucrose 1'-benzoate

There total 4 articles about Sucrose 1'-benzoate 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: 32.0%

: 1579-72-2
2,2,2-trifluoroethyl benzoate

: 57-50-1
Sucrose

: 123499-67-2
1'-O-benzoylsucrose

Guidance literature:: With protease N; In N,N-dimethyl-formamide; at 45 ℃; for 48h;

Reference yield:

: 93-97-0
benzoic acid anhydride

: 57-50-1
Sucrose

: 123499-67-2
1'-O-benzoylsucrose

: 2-O-Benzoylsucrose

Guidance literature:: With lithium hydroxide; In N,N-dimethyl-formamide; Yield given. Yields of byproduct given; 1.) r.t., overnight, 2.) 0 deg C, 1.5 h;

Reference yield:

: 93-97-0
benzoic acid anhydride

: 57-50-1
Sucrose

: 123499-67-2
1'-O-benzoylsucrose

: 6'-O-Benzoylsucrose

: 2-O-Benzoylsucrose

: 4'-O-Benzoylsucrose

Guidance literature:: With pyridine; for 40h; Yield given. Further byproducts given. Title compound not separated from byproducts; Ambient temperature;