(1S,3R,4R,5R)-1,3,4-Trihydroxy-6-oxabicyclo(3.2.1)octan-7-one

Base Information Edit

Chemical Name:(1S,3R,4R,5R)-1,3,4-Trihydroxy-6-oxabicyclo(3.2.1)octan-7-one
CAS No.:665-27-0
Molecular Formula:C7H10O5
Molecular Weight:174.153
Hs Code.:9999999999
UNII:3WCU7C8534
DSSTox Substance ID:DTXSID30435861
Nikkaji Number:J821.874I
Wikidata:Q82250974
Mol file:665-27-0.mol

Synonyms:665-27-0;(1S,3R,4R,5R)-1,3,4-Trihydroxy-6-oxabicyclo(3.2.1)octan-7-one;3WCU7C8534;(1S,3R,4R,5R)-1,3,4-trihydroxy-6-oxabicyclo[3.2.1]octan-7-one;UNII-3WCU7C8534;(-)-Quinic acid gamma-lactone;Quinic acid gamma-lactone, (-)-;6-Oxabicyclo(3.2.1)octan-7-one, 1,3,4-trihydroxy-, (1S,3R,4R,5R)-;L-Quinide;SCHEMBL1604382;DTXSID30435861;(-)-QUINIC ACID .GAMMA.-LACTONE;QUINIC ACID .GAMMA.-LACTONE, (-)-

Suppliers and Price of (1S,3R,4R,5R)-1,3,4-Trihydroxy-6-oxabicyclo(3.2.1)octan-7-one

Supply Marketing:Edit

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

TRC
(-)-QuinicAcidγ-Lactone
50mg
$ 95.00

Apolloscientific
Quinicacidgamma-lactone
25mg
$ 1484.00

Apolloscientific
Quinicacidgamma-lactone
10mg
$ 791.00

Total 1 raw suppliers

Chemical Property of (1S,3R,4R,5R)-1,3,4-Trihydroxy-6-oxabicyclo(3.2.1)octan-7-one Edit

Chemical Property:

Melting Point:185-187 °C
Boiling Point:395.4±42.0 °C(Predicted)
PSA：86.99000
Density:1.810±0.06 g/cm3(Predicted)
LogP:-1.84150
XLogP3:-1.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:0
Exact Mass:174.05282342
Heavy Atom Count:12
Complexity:228

Purity/Quality:

99% ^*data from raw suppliers

(-)-QuinicAcidγ-Lactone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C(C(C2CC1(C(=O)O2)O)O)O
Isomeric SMILES:C1[C@H]([C@H]([C@H]2C[C@@]1(C(=O)O2)O)O)O
Uses (-)-Quinic Acid γ-Lactone is an intermediate in the synthesis of 4-O-(E)-Feruloylquinic Acid (F308985). 4-O-(E)-Feruloylquinic Acid is a phenolic acid with potential antioxidant and antifungal activities. Secondary metabolite in the coffee brewing process.

Technology Process of (1S,3R,4R,5R)-1,3,4-Trihydroxy-6-oxabicyclo(3.2.1)octan-7-one

There total 10 articles about (1S,3R,4R,5R)-1,3,4-Trihydroxy-6-oxabicyclo(3.2.1)octan-7-one 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: 100.0%